1-[5-azanyl-6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-6-oxidanylidene-hexyl]-3-phenyl-urea

Systemtic Name: 1-[5-azanyl-6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-6-oxidanylidene-hexyl]-3-phenyl-urea Openeye Name: 1-[5-amino-6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-6-oxo-hexyl]-3-phenyl-urea CAS Name: 1-[5-amino-6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-6-oxohexyl]-3-phenylurea IUPAC Name: 1-[5-amino-6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-6-oxohexyl]-3-phenylurea Traditional Name: 1-[5-amino-6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-6-keto-hexyl]-3-phenyl-urea Formula: C24H32N4O4 MolecularWeight: 440.53528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C(CCCCNC(=O)NC3=CC=CC=C3)N)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C(CCCCNC(=O)NC3=CC=CC=C3)N)OC

InChI

InChI=1S/C24H32N4O4/c1-31-21-14-17-11-13-28(16-18(17)15-22(21)32-2)23(29)20(25)10-6-7-12-26-24(30)27-19-8-4-3-5-9-19/h3-5,8-9,14-15,20H,6-7,10-13,16,25H2,1-2H3,(H2,26,27,30)