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

Systemtic Name: N-[[2-(dimethylamino)-5-(2-methylpropanoylamino)phenyl]methyl]-N-propan-2-yl-thiophene-2-carboxamide Openeye Name: N-[[2-(dimethylamino)-5-(2-methylpropanoylamino)phenyl]methyl]-N-isopropyl-thiophene-2-carboxamide CAS Name: N-[[2-(dimethylamino)-5-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-N-propan-2-yl-2-thiophenecarboxamide IUPAC Name: N-[[2-(dimethylamino)-5-(2-methylpropanoylamino)phenyl]methyl]-N-propan-2-ylthiophene-2-carboxamide Traditional Name: N-[2-(dimethylamino)-5-(isobutyrylamino)benzyl]-N-isopropyl-thiophene-2-carboxamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1)N(C)C)CN(C(C)C)C(=O)C2=CC=CS2

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1)N(C)C)CN(C(C)C)C(=O)C2=CC=CS2

InChI

InChI=1S/C21H29N3O2S/c1-14(2)20(25)22-17-9-10-18(23(5)6)16(12-17)13-24(15(3)4)21(26)19-8-7-11-27-19/h7-12,14-15H,13H2,1-6H3,(H,22,25)