4,5-dimethyl-2-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-2-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiophene-3-carboxamide CAS Name: 4,5-dimethyl-2-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiophene-3-carboxamide Traditional Name: 4,5-dimethyl-2-[(4-pyrrolidinosulfonylbenzoyl)amino]thiophene-3-carboxamide Formula: C18H21N3O4S2 MolecularWeight: 407.50704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C18H21N3O4S2/c1-11-12(2)26-18(15(11)16(19)22)20-17(23)13-5-7-14(8-6-13)27(24,25)21-9-3-4-10-21/h5-8H,3-4,9-10H2,1-2H3,(H2,19,22)(H,20,23)