1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-cyclopentyl-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]-3-p-phenetyl-thiourea Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC3=C(C(=CC=C3)C)NC2=O)C4CCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC3=C(C(=CC=C3)C)NC2=O)C4CCCC4

InChI

InChI=1S/C25H29N3O2S/c1-3-30-22-13-11-20(12-14-22)26-25(31)28(21-9-4-5-10-21)16-19-15-18-8-6-7-17(2)23(18)27-24(19)29/h6-8,11-15,21H,3-5,9-10,16H2,1-2H3,(H,26,31)(H,27,29)