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

Systemtic Name: 1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-benzyl-1-(4-fluorobenzyl)-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C26H24FN3OS MolecularWeight: 445.551663

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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)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=C(C=C3)F)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C26H24FN3OS/c1-18-7-10-21-14-22(25(31)29-24(21)13-18)17-30(16-20-8-11-23(27)12-9-20)26(32)28-15-19-5-3-2-4-6-19/h2-14H,15-17H2,1H3,(H,28,32)(H,29,31)