7-chloranyl-2-[(5-methyl-1H-imidazol-4-yl)methyl]-6-[(phenylmethyl)amino]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 7-chloranyl-2-[(5-methyl-1H-imidazol-4-yl)methyl]-6-[(phenylmethyl)amino]-3,4-dihydroisoquinolin-1-one Openeye Name: 6-(benzylamino)-7-chloro-2-[(5-methyl-1H-imidazol-4-yl)methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 7-chloro-2-[(5-methyl-1H-imidazol-4-yl)methyl]-6-[(phenylmethyl)amino]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6-(benzylamino)-7-chloro-2-[(5-methyl-1H-imidazol-4-yl)methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 6-(benzylamino)-7-chloro-2-[(5-methyl-1H-imidazol-4-yl)methyl]-3,4-dihydroisocarbostyril Formula: C21H21ClN4O MolecularWeight: 380.87064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CN2CCC3=CC(=C(C=C3C2=O)Cl)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=CN1)CN2CCC3=CC(=C(C=C3C2=O)Cl)NCC4=CC=CC=C4

InChI

InChI=1S/C21H21ClN4O/c1-14-20(25-13-24-14)12-26-8-7-16-9-19(18(22)10-17(16)21(26)27)23-11-15-5-3-2-4-6-15/h2-6,9-10,13,23H,7-8,11-12H2,1H3,(H,24,25)