Vitas-M small molecule compound
2-{[(4-chloro-2-nitrophenyl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Catalog ID
STK427798
SMILES Clc1ccc(c(c1)[N+](=O)[O-])C(=O)Nc1sc2c(c1C(=O)N)CCCCC2
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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 C17H16ClN3O4S MW 393.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN3O4S/c18-9-6-7-10(12(8-9)21(24)25)16(23)20-17-14(15(19)22)11-4-2-1-3-5-13(11)26-17/h6-8H,1-5H2,(H2,19,22)(H,20,23)InChIKey
ALLSZWCFPHPUQC-UHFFFAOYSA-NSynonyms
2(((4chloro2nitrophenyl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
2((4chloro2nitrobenzoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)C3=C(C=C(C=C3)Cl)(N+)(=O)(O)
Clc1ccc(c(c1)(N+)(=O)(O))C(=O)Nc1sc2c(c1C(=O)N)CCCCC2
InChI=1SC17H16ClN3O4Sc1896710(12(89)21(24)25)16(23)201714(15(19)22)114213513(11)2617h68H15H2(H21922)(H2023)
MFCD01340992
ZINC000001200019
ZINC01200019
ZINC1200019
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