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

Systemtic Name: 1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-benzyl-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)N(CC2=CC=CC=C2)CC3=CC4=C(C=C(C=C4)OC)NC3=O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N(CC2=CC=CC=C2)CC3=CC4=C(C=C(C=C4)OC)NC3=O

InChI

InChI=1S/C26H25N3O3S/c1-31-22-12-9-21(10-13-22)27-26(33)29(16-18-6-4-3-5-7-18)17-20-14-19-8-11-23(32-2)15-24(19)28-25(20)30/h3-15H,16-17H2,1-2H3,(H,27,33)(H,28,30)