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

Systemtic Name: 3-(4-fluorophenyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(4-fluorophenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-(4-fluorophenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(4-fluorophenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-benzyl-3-(4-fluorophenyl)-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C25H22FN3OS MolecularWeight: 431.525083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=S)NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=S)NC4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN3OS/c1-17-6-5-9-19-14-20(24(30)28-23(17)19)16-29(15-18-7-3-2-4-8-18)25(31)27-22-12-10-21(26)11-13-22/h2-14H,15-16H2,1H3,(H,27,31)(H,28,30)