Vitas-M small molecule compound

2-{[(3-methyl-4-nitrophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK299403
SMILES O=C(c1ccc(c(c1)C)[N+](=O)[O-])Nc1sc2c(c1C(=O)N)CCCC2

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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 C17H17N3O4S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4S/c1-9-8-10(6-7-12(9)20(23)24)16(22)19-17-14(15(18)21)11-4-2-3-5-13(11)25-17/h6-8H,2-5H2,1H3,(H2,18,21)(H,19,22)
InChIKey
XAXMUTOFVIWWRR-UHFFFAOYSA-N
Synonyms
353467-00-2
2(((3methyl4nitrophenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxamide
2((3methyl4nitrobenzoyl)amino)4567tetrahydro1benzothiophene3carboxamide
353467002
CC1=C(C=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N)(N+)(=O)(O)
InChI=1SC17H17N3O4Sc19810(6712(9)20(23)24)16(22)191714(15(18)21)11423513(11)2517h68H25H21H3(H21821)(H1922)
MFCD01328055
O=C(c1ccc(c(c1)C)(N+)(=O)(O))Nc1sc2c(c1C(=O)N)CCCC2
ZINC000000994038
ZINC00994038
ZINC994038

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Available files

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