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

Systemtic Name: 1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-prop-2-enyl-urea Openeye Name: 1-allyl-3-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-prop-2-enylurea IUPAC Name: 1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-prop-2-enylurea Traditional Name: 1-allyl-3-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O2/c1-4-8-18-17(22)19-15-6-5-13-7-9-20(11-14(13)10-15)16(21)12(2)3/h4-6,10,12H,1,7-9,11H2,2-3H3,(H2,18,19,22)