Vitas-M small molecule compound
N-[(4-chloro-3-nitrophenyl)carbamothioyl]-3-methyl-1-benzofuran-2-carboxamide
Catalog ID
STK038416
SMILES S=C(NC(=O)c1oc2c(c1C)cccc2)Nc1ccc(c(c1)[N+](=O)[O-])Cl
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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 C17H12ClN3O4S MW 389.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClN3O4S/c1-9-11-4-2-3-5-14(11)25-15(9)16(22)20-17(26)19-10-6-7-12(18)13(8-10)21(23)24/h2-8H,1H3,(H2,19,20,22,26)InChIKey
ZTSLJJBQAYIGHU-UHFFFAOYSA-NSynonyms
CC1=C(OC2=CC=CC=C12)C(=O)NC(=S)NC3=CC(=C(C=C3)Cl)(N+)(=O)(O)
InChI=1SC17H12ClN3O4Sc1911423514(11)2515(9)16(22)2017(26)19106712(18)13(810)21(23)24h28H1H3(H219202226)
MFCD03031321
N((4CHLORO3NITROPHENYL)CARBAMOTHIOYL)3METHYL1BENZOFURAN2CARBOXAMIDE
S=C(NC(=O)c1oc2c(c1C)cccc2)Nc1ccc(c(c1)(N+)(=O)(O))Cl
STK038416
ZINC000001175958
ZINC01175958
ZINC1175958
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