1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-cyclopentyl-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]-3-p-phenetyl-thiourea Formula: C25H29N3O2S MolecularWeight: 435.58166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O2S/c1-3-30-22-12-10-20(11-13-22)26-25(31)28(21-6-4-5-7-21)16-19-15-18-9-8-17(2)14-23(18)27-24(19)29/h8-15,21H,3-7,16H2,1-2H3,(H,26,31)(H,27,29)