N-[3-[[cyclopropyl(2-ethylbutanoyl)amino]methyl]-4-(dimethylamino)phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[[cyclopropyl(2-ethylbutanoyl)amino]methyl]-4-(dimethylamino)phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[[cyclopropyl(2-ethylbutanoyl)amino]methyl]-4-(dimethylamino)phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[cyclopropyl-(2-ethyl-1-oxobutyl)amino]methyl]-4-(dimethylamino)phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[cyclopropyl(2-ethylbutanoyl)amino]methyl]-4-(dimethylamino)phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[[cyclopropyl(2-ethylbutanoyl)amino]methyl]-4-(dimethylamino)phenyl]thiophene-2-carboxamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N(CC1=C(C=CC(=C1)NC(=O)C2=CC=CS2)N(C)C)C3CC3

Isomeric SMILES

CCC(CC)C(=O)N(CC1=C(C=CC(=C1)NC(=O)C2=CC=CS2)N(C)C)C3CC3

InChI

InChI=1S/C23H31N3O2S/c1-5-16(6-2)23(28)26(19-10-11-19)15-17-14-18(9-12-20(17)25(3)4)24-22(27)21-8-7-13-29-21/h7-9,12-14,16,19H,5-6,10-11,15H2,1-4H3,(H,24,27)