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

Systemtic Name: 3-cyclohexyl-1-[(4-fluorophenyl)methyl]-1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-cyclohexyl-1-[(4-fluorophenyl)methyl]-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-cyclohexyl-1-[(4-fluorophenyl)methyl]-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-cyclohexyl-1-[(4-fluorophenyl)methyl]-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-cyclohexyl-1-(4-fluorobenzyl)-1-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C25H28FN3O2S MolecularWeight: 453.572123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=C(C=C3)F)C(=S)NC4CCCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=C(C=C3)F)C(=S)NC4CCCCC4

InChI

InChI=1S/C25H28FN3O2S/c1-31-22-11-12-23-18(14-22)13-19(24(30)28-23)16-29(15-17-7-9-20(26)10-8-17)25(32)27-21-5-3-2-4-6-21/h7-14,21H,2-6,15-16H2,1H3,(H,27,32)(H,28,30)