1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-1-p-anisyl-3-p-phenetyl-thiourea Formula: C29H31N3O5S MolecularWeight: 533.63854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)OC)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)OC)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC

InChI

InChI=1S/C29H31N3O5S/c1-5-37-24-12-8-22(9-13-24)30-29(38)32(17-19-6-10-23(34-2)11-7-19)18-21-14-20-15-26(35-3)27(36-4)16-25(20)31-28(21)33/h6-16H,5,17-18H2,1-4H3,(H,30,38)(H,31,33)