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

Systemtic Name: 1-(3-methylbutyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-3-(4-propan-2-ylphenyl)urea Openeye Name: 1-isopentyl-3-(4-isopropylphenyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]urea CAS Name: 1-(3-methylbutyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-(4-propan-2-ylphenyl)urea IUPAC Name: 1-(3-methylbutyl)-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-(4-propan-2-ylphenyl)urea Traditional Name: 1-isoamyl-1-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-p-cumenyl-urea Formula: C27H37N3O2 MolecularWeight: 435.60158

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2CCN1C(=O)CN(CCC(C)C)C(=O)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1C2=CC=CC=C2CCN1C(=O)CN(CCC(C)C)C(=O)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C27H37N3O2/c1-19(2)14-16-29(27(32)28-24-12-10-22(11-13-24)20(3)4)18-26(31)30-17-15-23-8-6-7-9-25(23)21(30)5/h6-13,19-21H,14-18H2,1-5H3,(H,28,32)