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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)C(=S)NC4=C(C=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)C(=S)NC4=C(C=C(C=C4)OC)OC)C

InChI

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