Vitas-M small molecule compound

N-cyclohexyl-2-(methyl{[(2-nitrophenyl)carbonyl]carbamothioyl}amino)benzamide

Catalog ID
STL069223
SMILES S=C(N(c1ccccc1C(=O)NC1CCCCC1)C)NC(=O)c1ccccc1[N+](=O)[O-]

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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 C22H24N4O4S MW 440.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O4S/c1-25(22(31)24-21(28)17-12-6-8-14-19(17)26(29)30)18-13-7-5-11-16(18)20(27)23-15-9-3-2-4-10-15/h5-8,11-15H,2-4,9-10H2,1H3,(H,23,27)(H,24,28,31)
InChIKey
IUHXSWVBXOWFRF-UHFFFAOYSA-N
Synonyms

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)C3=CC=CC=C3(N+)(=O)(O)
InChI=1SC22H24N4O4Sc125(22(31)2421(28)1712681419(17)26(29)30)1813751116(18)20(27)231593241015h581115H24910H21H3(H2327)(H242831)
MFCD05871323
Ncyclohexyl2(methyl(((2nitrophenyl)carbonyl)carbamothioyl)amino)benzamide
NCYCLOHEXYL2(METHYL((2NITROBENZOYL)CARBAMOTHIOYL)AMINO)BENZAMIDE
S=C(N(c1ccccc1C(=O)NC1CCCCC1)C)NC(=O)c1ccccc1(N+)(=O)(O)
ZINC000012293012
ZINC12293012

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Available files

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