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

Systemtic Name: 3-(2-methoxyphenyl)-1-(3-methylbutyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]urea Openeye Name: 1-isopentyl-3-(2-methoxyphenyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]urea CAS Name: 3-(2-methoxyphenyl)-1-(3-methylbutyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]urea IUPAC Name: 3-(2-methoxyphenyl)-1-(3-methylbutyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]urea Traditional Name: 1-isoamyl-1-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(2-methoxyphenyl)urea Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2CCN1C(=O)CN(CCC(C)C)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1C2=CC=CC=C2CCN1C(=O)CN(CCC(C)C)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C25H33N3O3/c1-18(2)13-15-27(25(30)26-22-11-7-8-12-23(22)31-4)17-24(29)28-16-14-20-9-5-6-10-21(20)19(28)3/h5-12,18-19H,13-17H2,1-4H3,(H,26,30)