Vitas-M small molecule compound
(3Z)-3-(4-methylbenzylidene)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-2,3-dihydro-1H-indole
Catalog ID
STK774790
SMILES Cc1ccc(cc1)/C=C/1\CN(c2c1c(cc(c2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)c1ccc(cc1)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 C23H19N3O6S MW 465.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O6S/c1-15-3-7-17(8-4-15)11-18-14-24(33(31,32)20-9-5-16(2)6-10-20)21-12-19(25(27)28)13-22(23(18)21)26(29)30/h3-13H,14H2,1-2H3/b18-11+InChIKey
VQQJCZRQGDKTQQ-WOJGMQOQSA-NSynonyms
(3Z)3((4METHYLPHENYL)METHYLIDENE)1(4METHYLPHENYL)SULFONYL46DINITRO2HINDOLE
(3Z)3(4methylbenzylidene)1((4methylphenyl)sulfonyl)46dinitro23dihydro1Hindole
CC1=CC=C(C=C1)C=C2CN(C3=CC(=CC(=C23)(N+)(=O)(O))(N+)(=O)(O))S(=O)(=O)C4=CC=C(C=C4)C
Cc1ccc(cc1)C=C1CN(c2c1c(cc(c2)(N+)(=O)(O))(N+)(=O)(O))S(=O)(=O)c1ccc(cc1)C
InChI=1SC23H19N3O6Sc1153717(8415)11181424(33(3132)209516(2)61020)211219(25(27)28)1322(23(18)21)26(29)30h313H14H212H3b1811+
MFCD04061304
ZINC000012447468
ZINC12447468
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