1-butyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-3-(2-methylphenyl)urea

Systemtic Name: 1-butyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-3-(2-methylphenyl)urea Openeye Name: 1-butyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-3-(o-tolyl)urea CAS Name: 1-butyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-(2-methylphenyl)urea IUPAC Name: 1-butyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-(2-methylphenyl)urea Traditional Name: 1-butyl-1-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(o-tolyl)urea Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C24H31N3O2/c1-4-5-15-26(24(29)25-22-13-9-6-10-18(22)2)17-23(28)27-16-14-20-11-7-8-12-21(20)19(27)3/h6-13,19H,4-5,14-17H2,1-3H3,(H,25,29)