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

Systemtic Name: 3-cyclohexyl-1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-cyclohexyl-1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-cyclohexyl-1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-cyclohexyl-1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-cyclohexyl-1-(4-fluorobenzyl)-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C25H28FN3OS MolecularWeight: 437.572723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=C(C=C3)F)C(=S)NC4CCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=C(C=C3)F)C(=S)NC4CCCCC4

InChI

InChI=1S/C25H28FN3OS/c1-17-7-10-19-14-20(24(30)28-23(19)13-17)16-29(15-18-8-11-21(26)12-9-18)25(31)27-22-5-3-2-4-6-22/h7-14,22H,2-6,15-16H2,1H3,(H,27,31)(H,28,30)