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

Systemtic Name: 1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea CAS Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea Traditional Name: 1-benzyl-1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-3-(4-fluorophenyl)thiourea Formula: C26H24FN3O2S MolecularWeight: 461.551063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=S)NC4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=S)NC4=CC=C(C=C4)F

InChI

InChI=1S/C26H24FN3O2S/c1-2-32-23-12-13-24-19(15-23)14-20(25(31)29-24)17-30(16-18-6-4-3-5-7-18)26(33)28-22-10-8-21(27)9-11-22/h3-15H,2,16-17H2,1H3,(H,28,33)(H,29,31)