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

Systemtic Name: N-cyclopropyl-N-[[2-(dimethylamino)-5-(2-methylpropanoylamino)phenyl]methyl]thiophene-2-carboxamide Openeye Name: N-cyclopropyl-N-[[2-(dimethylamino)-5-(2-methylpropanoylamino)phenyl]methyl]thiophene-2-carboxamide CAS Name: N-cyclopropyl-N-[[2-(dimethylamino)-5-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-cyclopropyl-N-[[2-(dimethylamino)-5-(2-methylpropanoylamino)phenyl]methyl]thiophene-2-carboxamide Traditional Name: N-cyclopropyl-N-[2-(dimethylamino)-5-(isobutyrylamino)benzyl]thiophene-2-carboxamide Formula: C21H27N3O2S MolecularWeight: 385.52298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1)N(C)C)CN(C2CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1)N(C)C)CN(C2CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C21H27N3O2S/c1-14(2)20(25)22-16-7-10-18(23(3)4)15(12-16)13-24(17-8-9-17)21(26)19-6-5-11-27-19/h5-7,10-12,14,17H,8-9,13H2,1-4H3,(H,22,25)