Vitas-M small molecule compound

(2'S,3S,3'S,10b'R)-2'-[(2-chlorophenyl)carbonyl]-3'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one

Catalog ID
STK594072
SMILES O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3)c1cccs1

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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 C31H21ClN2O3S MW 537.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H21ClN2O3S/c32-22-12-5-3-10-20(22)27(35)25-26(28(36)24-14-7-17-38-24)34-16-15-18-8-1-2-9-19(18)29(34)31(25)21-11-4-6-13-23(21)33-30(31)37/h1-17,25-26,29H,(H,33,37)/t25-,26-,29+,31+/m0/s1
InChIKey
QPARVUIKLKCSRX-FJUJMQFGSA-N
Synonyms
1177698-98-4
(1S2S3S10bR)2(2chlorobenzoyl)3(thiophene2carbonyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)2((2chlorophenyl)carbonyl)3(thiophen2ylcarbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)2(2chlorobenzoyl)3(thiophene2carbonyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1177698984
C1=CC=C2C3C4(C(C(N3C=CC2=C1)C(=O)C5=CC=CS5)C(=O)C6=CC=CC=C6Cl)C7=CC=CC=C7NC4=O
InChI=1SC31H21ClN2O3Sc322212531020(22)27(35)2526(28(36)24147173824)34161518812919(18)29(34)31(25)2111461323(21)3330(31)37h117252629H(H3337)t252629+31+m0s1
MFCD18245980
O=C((C@H)1N2C=Cc3c((C@@H)2(C@@)2((C@@H)1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3)c1cccs1
ZINC000101272109
ZINC101272109

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Available files

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