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

Systemtic Name: 3-(3-chlorophenyl)-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(3-chlorophenyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-(3-chlorophenyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(3-chlorophenyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-benzyl-3-(3-chlorophenyl)-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C25H22ClN3O2S MolecularWeight: 463.97908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22ClN3O2S/c1-31-22-11-10-18-12-19(24(30)28-23(18)14-22)16-29(15-17-6-3-2-4-7-17)25(32)27-21-9-5-8-20(26)13-21/h2-14H,15-16H2,1H3,(H,27,32)(H,28,30)