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

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[(4-methylphenyl)methyl]-3-(2-methylpropyl)thiourea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-isobutyl-1-(p-tolylmethyl)thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methylphenyl)methyl]-3-(2-methylpropyl)thiourea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methylphenyl)methyl]-3-(2-methylpropyl)thiourea Traditional Name: 3-isobutyl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-1-(4-methylbenzyl)thiourea Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C(=S)NCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C(=S)NCC(C)C

InChI

InChI=1S/C25H31N3O3S/c1-16(2)13-26-25(32)28(14-18-8-6-17(3)7-9-18)15-20-10-19-11-22(30-4)23(31-5)12-21(19)27-24(20)29/h6-12,16H,13-15H2,1-5H3,(H,26,32)(H,27,29)