Vitas-M small molecule compound
2-{[(2-chloro-5-nitrophenyl)carbonyl]amino}-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK418006
SMILES CCCC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(ccc1Cl)[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 C19H20ClN3O4S MW 421.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20ClN3O4S/c1-2-3-10-4-6-12-15(8-10)28-19(16(12)17(21)24)22-18(25)13-9-11(23(26)27)5-7-14(13)20/h5,7,9-10H,2-4,6,8H2,1H3,(H2,21,24)(H,22,25)InChIKey
AQQYAQZGKJBQMO-UHFFFAOYSA-NSynonyms
2(((2chloro5nitrophenyl)carbonyl)amino)6propyl4567tetrahydro1benzothiophene3carboxamide
2((2chloro5nitrobenzoyl)amino)6propyl4567tetrahydro1benzothiophene3carboxamide
CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl
CCCC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(ccc1Cl)(N+)(=O)(O)
InChI=1SC19H20ClN3O4Sc12310461215(810)2819(16(12)17(21)24)2218(25)13911(23(26)27)5714(13)20h57910H2468H21H3(H22124)(H2225)
MFCD01919904
ZINC000002744470
ZINC000002744471
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