Vitas-M small molecule compound
(2'S,3S,3'S,10b'R)-2'-[(4-nitrophenyl)carbonyl]-3'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Catalog ID
STK573343
SMILES O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)[N+](=O)[O-])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 C31H21N3O5S MW 547.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H21N3O5S/c35-27(19-11-13-20(14-12-19)34(38)39)25-26(28(36)24-10-5-17-40-24)33-16-15-18-6-1-2-7-21(18)29(33)31(25)22-8-3-4-9-23(22)32-30(31)37/h1-17,25-26,29H,(H,32,37)/t25-,26-,29+,31+/m0/s1InChIKey
HZJJTVSUAGHUPD-FJUJMQFGSA-NSynonyms
1177728-28-7(1S2S3S10bR)2(4nitrobenzoyl)3(thiophene2carbonyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)2((4nitrophenyl)carbonyl)3(thiophen2ylcarbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)2(4nitrobenzoyl)3(thiophene2carbonyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1177728287
C1=CC=C2C3C4(C(C(N3C=CC2=C1)C(=O)C5=CC=CS5)C(=O)C6=CC=C(C=C6)(N+)(=O)(O))C7=CC=CC=C7NC4=O
InChI=1SC31H21N3O5Sc3527(19111320(141219)34(38)39)2526(28(36)24105174024)33161518612721(18)29(33)31(25)22834923(22)3230(31)37h117252629H(H3237)t252629+31+m0s1
MFCD18245473
O=C((C@H)1N2C=Cc3c((C@@H)2(C@@)2((C@@H)1C(=O)c1ccc(cc1)(N+)(=O)(O))C(=O)Nc1c2cccc1)cccc3)c1cccs1
ZINC000101303498
ZINC101303498
Check stock
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Check stock on Vitas-MAvailable files
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