2-[2-[[3-(dimethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[2-[[3-(dimethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[2-[3-(dimethylcarbamoyl)anilino]-2-oxo-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-[3-[dimethylamino(oxo)methyl]anilino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[2-[3-(dimethylcarbamoyl)anilino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[2-[3-(dimethylcarbamoyl)anilino]-2-keto-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H24N4O3 MolecularWeight: 380.44026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=CC=C1)NC(=O)CN2CC3=CC=CC=C3CC2C(=O)N

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)NC(=O)CN2CC3=CC=CC=C3CC2C(=O)N

InChI

InChI=1S/C21H24N4O3/c1-24(2)21(28)15-8-5-9-17(10-15)23-19(26)13-25-12-16-7-4-3-6-14(16)11-18(25)20(22)27/h3-10,18H,11-13H2,1-2H3,(H2,22,27)(H,23,26)