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

Systemtic Name: 1-[(4-fluorophenyl)methyl]-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenylthiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenylthiourea Traditional Name: 1-(4-fluorobenzyl)-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea Formula: C25H22FN3O2S MolecularWeight: 447.524483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=C(C=C3)F)C(=S)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=C(C=C3)F)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C25H22FN3O2S/c1-31-22-12-9-18-13-19(24(30)28-23(18)14-22)16-29(15-17-7-10-20(26)11-8-17)25(32)27-21-5-3-2-4-6-21/h2-14H,15-16H2,1H3,(H,27,32)(H,28,30)