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

Systemtic Name: 1-cyclopentyl-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methylphenyl)thiourea Openeye Name: 1-cyclopentyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(p-tolyl)thiourea CAS Name: 1-cyclopentyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methylphenyl)thiourea IUPAC Name: 1-cyclopentyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methylphenyl)thiourea Traditional Name: 1-cyclopentyl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-3-(p-tolyl)thiourea Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C4CCCC4

InChI

InChI=1S/C25H29N3O3S/c1-16-8-10-19(11-9-16)26-25(32)28(20-6-4-5-7-20)15-18-12-17-13-22(30-2)23(31-3)14-21(17)27-24(18)29/h8-14,20H,4-7,15H2,1-3H3,(H,26,32)(H,27,29)