Vitas-M small molecule compound

2-[(1-{[4-(pyrrolidin-1-ylsulfonyl)phenyl]carbonyl}piperidin-4-yl)methyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione

Catalog ID
STK538977
SMILES O=C(c1ccc(cc1)S(=O)(=O)N1CCCC1)N1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C29H29N3O5S MW 531.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O5S/c33-27(22-9-11-23(12-10-22)38(36,37)31-15-1-2-16-31)30-17-13-20(14-18-30)19-32-28(34)24-7-3-5-21-6-4-8-25(26(21)24)29(32)35/h3-12,20H,1-2,13-19H2
InChIKey
PBCVFPLNIAEGRZ-UHFFFAOYSA-N
Synonyms
326882-05-7
2((1((4(pyrrolidin1ylsulfonyl)phenyl)carbonyl)piperidin4yl)methyl)1Hbenzo(de)isoquinoline13(2H)dione
2((1(4(1PYRROLIDINYLSULFONYL)BENZOYL)4PIPERIDINYL)METHYL)1HBENZO(DE)ISOQUINOLINE13(2H)DIONE
2((1(4(PYRROLIDIN1YLSULFONYL)BENZOYL)PIPERIDIN4YL)METHYL)1HBENZO(DE)ISOQUINOLINE13(2H)DIONE
2((1(4PYRROLIDIN1YLSULFONYLBENZOYL)PIPERIDIN4YL)METHYL)BENZO(DE)ISOQUINOLINE13DIONE
2((1(4PYRROLIDIN1YLSULFONYLPHENYL)CARBONYLPIPERIDIN4YL)METHYL)BENZO(DE)ISOQUINOLINE13DIONE
2((1(4PYRROLIDINOSULFONYLBENZOYL)4PIPERIDYL)METHYL)BENZO(DE)ISOQUINOLINE13QUINONE
2((1(OXO(4(1PYRROLIDINYLSULFONYL)PHENYL)METHYL)4PIPERIDINYL)METHYL)BENZO(DE)ISOQUINOLINE13DIONE
2(1(4(PYRROLIDINE1SULFONYL)BENZOYL)PIPERIDIN4YLMETHYL)BENZO(DE)ISOQUINOLINE13DIONE
326882057
C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(CC3)CN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O
InChI=1SC29H29N3O5Sc3327(2291123(121022)38(3637)3115121631)30171320(141830)193228(34)247352164825(26(21)24)29(32)35h31220H121319H2
MFCD02324574
ZINC000008431922
ZINC08431922
ZINC8431922

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Available files

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