3-(2,4-dimethoxyphenyl)-1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-phenethyl-thiourea

Systemtic Name: 3-(2,4-dimethoxyphenyl)-1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-phenethyl-thiourea Openeye Name: 3-(2,4-dimethoxyphenyl)-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-phenethyl-thiourea CAS Name: 3-(2,4-dimethoxyphenyl)-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-phenethylthiourea IUPAC Name: 3-(2,4-dimethoxyphenyl)-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-phenethylthiourea Traditional Name: 3-(2,4-dimethoxyphenyl)-1-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-1-phenethyl-thiourea Formula: C29H31N3O3S MolecularWeight: 501.63974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CCC3=CC=CC=C3)C(=S)NC4=C(C=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CCC3=CC=CC=C3)C(=S)NC4=C(C=C(C=C4)OC)OC)C

InChI

InChI=1S/C29H31N3O3S/c1-19-10-11-22-16-23(28(33)31-27(22)20(19)2)18-32(15-14-21-8-6-5-7-9-21)29(36)30-25-13-12-24(34-3)17-26(25)35-4/h5-13,16-17H,14-15,18H2,1-4H3,(H,30,36)(H,31,33)