1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1,3-bis(phenylmethyl)thiourea

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1,3-bis(phenylmethyl)thiourea Openeye Name: 1,3-dibenzyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1,3-bis(phenylmethyl)thiourea IUPAC Name: 1,3-dibenzyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1,3-dibenzyl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)C(=S)NCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)C(=S)NCC4=CC=CC=C4)OC

InChI

InChI=1S/C27H27N3O3S/c1-32-24-14-21-13-22(26(31)29-23(21)15-25(24)33-2)18-30(17-20-11-7-4-8-12-20)27(34)28-16-19-9-5-3-6-10-19/h3-15H,16-18H2,1-2H3,(H,28,34)(H,29,31)