N-[3-methyl-1-[[4-(1-methylimidazol-2-yl)carbonylphenyl]amino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-methyl-1-[[4-(1-methylimidazol-2-yl)carbonylphenyl]amino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-methyl-1-[[4-(1-methylimidazole-2-carbonyl)phenyl]carbamoyl]propyl]thiophene-2-carboxamide CAS Name: N-[3-methyl-1-[4-[(1-methyl-2-imidazolyl)-oxomethyl]anilino]-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-methyl-1-[4-(1-methylimidazole-2-carbonyl)anilino]-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-methyl-1-[[4-(1-methylimidazole-2-carbonyl)phenyl]carbamoyl]propyl]thiophene-2-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)C(=O)C2=NC=CN2C)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)C(=O)C2=NC=CN2C)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H22N4O3S/c1-13(2)17(24-20(27)16-5-4-12-29-16)21(28)23-15-8-6-14(7-9-15)18(26)19-22-10-11-25(19)3/h4-13,17H,1-3H3,(H,23,28)(H,24,27)