N-[[2-(dimethylamino)-5-(2-methylpropanoylamino)phenyl]methyl]-N-(2-methylpropyl)thiophene-2-carboxamide

Systemtic Name: N-[[2-(dimethylamino)-5-(2-methylpropanoylamino)phenyl]methyl]-N-(2-methylpropyl)thiophene-2-carboxamide Openeye Name: N-[[2-(dimethylamino)-5-(2-methylpropanoylamino)phenyl]methyl]-N-isobutyl-thiophene-2-carboxamide CAS Name: N-[[2-(dimethylamino)-5-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-N-(2-methylpropyl)-2-thiophenecarboxamide IUPAC Name: N-[[2-(dimethylamino)-5-(2-methylpropanoylamino)phenyl]methyl]-N-(2-methylpropyl)thiophene-2-carboxamide Traditional Name: N-[2-(dimethylamino)-5-(isobutyrylamino)benzyl]-N-isobutyl-thiophene-2-carboxamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=C(C=CC(=C1)NC(=O)C(C)C)N(C)C)C(=O)C2=CC=CS2

Isomeric SMILES

CC(C)CN(CC1=C(C=CC(=C1)NC(=O)C(C)C)N(C)C)C(=O)C2=CC=CS2

InChI

InChI=1S/C22H31N3O2S/c1-15(2)13-25(22(27)20-8-7-11-28-20)14-17-12-18(23-21(26)16(3)4)9-10-19(17)24(5)6/h7-12,15-16H,13-14H2,1-6H3,(H,23,26)