1-(phenylmethyl)-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea

Systemtic Name: 1-(phenylmethyl)-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-benzyl-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea CAS Name: 1-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Traditional Name: 1-benzyl-3-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C20H23N3O2 MolecularWeight: 337.41552

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O2/c1-2-19(24)23-11-10-16-8-9-18(12-17(16)14-23)22-20(25)21-13-15-6-4-3-5-7-15/h3-9,12H,2,10-11,13-14H2,1H3,(H2,21,22,25)