1-[6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-propyl-1-quinolin-4-yl-urea

Systemtic Name: 1-[6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-propyl-1-quinolin-4-yl-urea Openeye Name: 1-(1-benzyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-propyl-1-(4-quinolyl)urea CAS Name: 1-[6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-propyl-1-(4-quinolinyl)urea IUPAC Name: 1-(1-benzyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-propyl-1-quinolin-4-ylurea Traditional Name: 1-(1-benzyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-propyl-1-(4-quinolyl)urea Formula: C31H34N4O3 MolecularWeight: 510.62666

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N(C1=CC=NC2=CC=CC=C21)N3CCC4=CC(=C(C=C4C3CC5=CC=CC=C5)OC)OC

Isomeric SMILES

CCCNC(=O)N(C1=CC=NC2=CC=CC=C21)N3CCC4=CC(=C(C=C4C3CC5=CC=CC=C5)OC)OC

InChI

InChI=1S/C31H34N4O3/c1-4-16-33-31(36)35(27-14-17-32-26-13-9-8-12-24(26)27)34-18-15-23-20-29(37-2)30(38-3)21-25(23)28(34)19-22-10-6-5-7-11-22/h5-14,17,20-21,28H,4,15-16,18-19H2,1-3H3,(H,33,36)