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

Systemtic Name: 1-tert-butyl-3-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Openeye Name: 1-tert-butyl-3-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-tert-butyl-3-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-tert-butyl-3-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-tert-butyl-3-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NC(C)(C)C

Isomeric SMILES

CC(C)C(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NC(C)(C)C

InChI

InChI=1S/C18H27N3O2/c1-12(2)16(22)21-9-8-13-6-7-15(10-14(13)11-21)19-17(23)20-18(3,4)5/h6-7,10,12H,8-9,11H2,1-5H3,(H2,19,20,23)