Vitas-M small molecule compound

1-{1-chloro-4-(2,4-dichlorophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinolin-8-yl}ethanone

Catalog ID
STK531946
SMILES Clc1ccc(c(c1)Cl)C1Nc2ccc(cc2C2C1CC(C2Cl)Sc1ccccc1[N+](=O)[O-])C(=O)C

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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 C26H21Cl3N2O3S MW 547.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21Cl3N2O3S/c1-13(32)14-6-9-20-17(10-14)24-18(26(30-20)16-8-7-15(27)11-19(16)28)12-23(25(24)29)35-22-5-3-2-4-21(22)31(33)34/h2-11,18,23-26,30H,12H2,1H3
InChIKey
XMQITQVBHLNMNB-UHFFFAOYSA-N
Synonyms

1(1chloro4(24dichlorophenyl)2((2nitrophenyl)sulfanyl)233a459bhexahydro1Hcyclopenta(c)quinolin8yl)ethanone
1(1chloro4(24dichlorophenyl)2((2nitrophenyl)thio)233a459bhexahydro1Hcyclopenta(c)quinolin8yl)ethanone
1(1CHLORO4(24DICHLOROPHENYL)2(2NITROPHENYL)SULFANYL233A459BHEXAHYDRO1HCYCLOPENTA(C)QUINOLIN8YL)ETHANONE
CC(=O)C1=CC2=C(C=C1)NC(C3C2C(C(C3)SC4=CC=CC=C4(N+)(=O)(O))Cl)C5=C(C=C(C=C5)Cl)Cl
Clc1ccc(c(c1)Cl)C1Nc2ccc(cc2C2C1CC(C2Cl)Sc1ccccc1(N+)(=O)(O))C(=O)C
InChI=1SC26H21Cl3N2O3Sc113(32)14692017(1014)2418(26(3020)168715(27)1119(16)28)1223(25(24)29)3522532421(22)31(33)34h21118232630H12H21H3
MFCD01593514
ZINC000002216201
ZINC000229843695

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Available files

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