1-[(4-fluorophenyl)methyl]-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenylthiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenylthiourea Traditional Name: 1-(4-fluorobenzyl)-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea Formula: C25H22FN3OS MolecularWeight: 431.525083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=C(C=C3)F)C(=S)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=C(C=C3)F)C(=S)NC4=CC=CC=C4

InChI

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