1-cyclopentyl-3-(2-ethylphenyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1-cyclopentyl-3-(2-ethylphenyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-cyclopentyl-3-(2-ethylphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-cyclopentyl-3-(2-ethylphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-cyclopentyl-3-(2-ethylphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-cyclopentyl-3-(2-ethylphenyl)-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C25H29N3OS MolecularWeight: 419.58226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CC2=CC3=C(C=CC(=C3)C)NC2=O)C4CCCC4

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CC2=CC3=C(C=CC(=C3)C)NC2=O)C4CCCC4

InChI

InChI=1S/C25H29N3OS/c1-3-18-8-4-7-11-22(18)27-25(30)28(21-9-5-6-10-21)16-20-15-19-14-17(2)12-13-23(19)26-24(20)29/h4,7-8,11-15,21H,3,5-6,9-10,16H2,1-2H3,(H,26,29)(H,27,30)