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

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)thiourea Traditional Name: 1-benzyl-3-(2,4-dimethylphenyl)-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N(CC2=CC=CC=C2)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N(CC2=CC=CC=C2)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC)C

InChI

InChI=1S/C28H29N3O3S/c1-18-10-11-23(19(2)12-18)30-28(35)31(16-20-8-6-5-7-9-20)17-22-13-21-14-25(33-3)26(34-4)15-24(21)29-27(22)32/h5-15H,16-17H2,1-4H3,(H,29,32)(H,30,35)