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

Systemtic Name: 1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 3-benzyl-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-1-p-anisyl-thiourea Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2=CC3=C(C=C(C=C3)OC)NC2=O)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2=CC3=C(C=C(C=C3)OC)NC2=O)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O3S/c1-32-23-11-8-20(9-12-23)17-30(27(34)28-16-19-6-4-3-5-7-19)18-22-14-21-10-13-24(33-2)15-25(21)29-26(22)31/h3-15H,16-18H2,1-2H3,(H,28,34)(H,29,31)