Vitas-M small molecule compound
2-{[(2-chloro-5-nitrophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK412668
SMILES Clc1ccc(cc1C(=O)Nc1sc2c(c1C(=O)N)CCCC2)[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 C16H14ClN3O4S MW 379.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClN3O4S/c17-11-6-5-8(20(23)24)7-10(11)15(22)19-16-13(14(18)21)9-3-1-2-4-12(9)25-16/h5-7H,1-4H2,(H2,18,21)(H,19,22)InChIKey
PPKJBVQPDMHQFE-UHFFFAOYSA-NSynonyms
313662-59-82(((2chloro5nitrophenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxamide
2((2chloro5nitrobenzoyl)amino)4567tetrahydro1benzothiophene3carboxamide
313662598
C1CCC2=C(C1)C(=C(S2)NC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl)C(=O)N
Clc1ccc(cc1C(=O)Nc1sc2c(c1C(=O)N)CCCC2)(N+)(=O)(O)
InChI=1SC16H14ClN3O4Sc1711658(20(23)24)710(11)15(22)191613(14(18)21)9312412(9)2516h57H14H2(H21821)(H1922)
MFCD01243614
ZINC000000993979
ZINC00993979
ZINC993979
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