Vitas-M small molecule compound
2-{[(4-chloro-2-nitrophenyl)carbonyl]amino}-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK427747
SMILES CCCC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1ccc(cc1[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 C19H20ClN3O4S MW 421.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20ClN3O4S/c1-2-3-10-4-6-13-15(8-10)28-19(16(13)17(21)24)22-18(25)12-7-5-11(20)9-14(12)23(26)27/h5,7,9-10H,2-4,6,8H2,1H3,(H2,21,24)(H,22,25)InChIKey
XLUANCUFMVYAGM-UHFFFAOYSA-NSynonyms
2(((4chloro2nitrophenyl)carbonyl)amino)6propyl4567tetrahydro1benzothiophene3carboxamide
2((4chloro2nitrobenzoyl)amino)6propyl4567tetrahydro1benzothiophene3carboxamide
CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=C(C=C(C=C3)Cl)(N+)(=O)(O)
CCCC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1ccc(cc1(N+)(=O)(O))Cl
InChI=1SC19H20ClN3O4Sc12310461315(810)2819(16(13)17(21)24)2218(25)127511(20)914(12)23(26)27h57910H2468H21H3(H22124)(H2225)
MFCD01346308
ZINC000001201024
ZINC000001201025
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