1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-3-phenyl-thiourea

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-3-phenyl-thiourea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-3-phenyl-thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-3-phenylthiourea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-3-phenylthiourea Traditional Name: 1-homoveratryl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea Formula: C29H31N3O5S MolecularWeight: 533.63854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C(=S)NC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C(=S)NC4=CC=CC=C4)OC

InChI

InChI=1S/C29H31N3O5S/c1-34-24-11-10-19(14-25(24)35-2)12-13-32(29(38)30-22-8-6-5-7-9-22)18-21-15-20-16-26(36-3)27(37-4)17-23(20)31-28(21)33/h5-11,14-17H,12-13,18H2,1-4H3,(H,30,38)(H,31,33)