1-(3,5-dimethylphenyl)-3-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Openeye Name: 1-(3,5-dimethylphenyl)-3-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-(3,5-dimethylphenyl)-3-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-(3,5-dimethylphenyl)-3-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)NC2=CC3=C(CCN(C3)C(=O)C(C)C)C=C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)NC2=CC3=C(CCN(C3)C(=O)C(C)C)C=C2)C

InChI

InChI=1S/C22H27N3O2/c1-14(2)21(26)25-8-7-17-5-6-19(12-18(17)13-25)23-22(27)24-20-10-15(3)9-16(4)11-20/h5-6,9-12,14H,7-8,13H2,1-4H3,(H2,23,24,27)