1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-phenethyl-thiourea

Systemtic Name: 1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-phenethyl-thiourea Openeye Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-phenethyl-thiourea CAS Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-phenethylthiourea IUPAC Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-phenethylthiourea Traditional Name: 1-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]-1-p-anisyl-3-phenethyl-thiourea Formula: C29H31N3O2S MolecularWeight: 485.64034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CC3=CC=C(C=C3)OC)C(=S)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CC3=CC=C(C=C3)OC)C(=S)NCCC4=CC=CC=C4

InChI

InChI=1S/C29H31N3O2S/c1-20-9-10-21(2)27-26(20)17-24(28(33)31-27)19-32(18-23-11-13-25(34-3)14-12-23)29(35)30-16-15-22-7-5-4-6-8-22/h4-14,17H,15-16,18-19H2,1-3H3,(H,30,35)(H,31,33)