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

Systemtic Name: 3-(4-ethylphenyl)-1-(3-methylbutyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]urea Openeye Name: 3-(4-ethylphenyl)-1-isopentyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]urea CAS Name: 3-(4-ethylphenyl)-1-(3-methylbutyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]urea IUPAC Name: 3-(4-ethylphenyl)-1-(3-methylbutyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]urea Traditional Name: 3-(4-ethylphenyl)-1-isoamyl-1-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]urea Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)N(CCC(C)C)CC(=O)N2CCC3=CC=CC=C3C2C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)N(CCC(C)C)CC(=O)N2CCC3=CC=CC=C3C2C

InChI

InChI=1S/C26H35N3O2/c1-5-21-10-12-23(13-11-21)27-26(31)28(16-14-19(2)3)18-25(30)29-17-15-22-8-6-7-9-24(22)20(29)4/h6-13,19-20H,5,14-18H2,1-4H3,(H,27,31)