Vitas-M small molecule compound
2-{[(4-nitrophenyl)carbonyl]amino}-N-(prop-2-en-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK897105
SMILES C=CCNC(=O)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])sc2c1CCCC2
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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 C19H19N3O4S MW 385.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O4S/c1-2-11-20-18(24)16-14-5-3-4-6-15(14)27-19(16)21-17(23)12-7-9-13(10-8-12)22(25)26/h2,7-10H,1,3-6,11H2,(H,20,24)(H,21,23)InChIKey
HWYAWDUPARWSAF-UHFFFAOYSA-NSynonyms
432020-69-42(((4nitrophenyl)carbonyl)amino)N(prop2en1yl)4567tetrahydro1benzothiophene3carboxamide
2((4nitrobenzoyl)amino)Nprop2enyl4567tetrahydro1benzothiophene3carboxamide
432020694
C=CCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
C=CCNC(=O)c1c(NC(=O)c2ccc(cc2)(N+)(=O)(O))sc2c1CCCC2
InChI=1SC19H19N3O4Sc12112018(24)1614534615(14)2719(16)2117(23)127913(10812)22(25)26h2710H13611H2(H2024)(H2123)
MFCD02978259
ZINC000002677512
ZINC02677512
ZINC2677512
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