1-cyclopentyl-1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea

Systemtic Name: 1-cyclopentyl-1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea Openeye Name: 1-cyclopentyl-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea CAS Name: 1-cyclopentyl-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-cyclopentyl-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea Traditional Name: 1-cyclopentyl-3-(4-fluorophenyl)-1-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C24H26FN3OS MolecularWeight: 423.546143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(C3CCCC3)C(=S)NC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(C3CCCC3)C(=S)NC4=CC=C(C=C4)F)C

InChI

InChI=1S/C24H26FN3OS/c1-15-7-8-17-13-18(23(29)27-22(17)16(15)2)14-28(21-5-3-4-6-21)24(30)26-20-11-9-19(25)10-12-20/h7-13,21H,3-6,14H2,1-2H3,(H,26,30)(H,27,29)