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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3OC)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3OC)C(=S)NCC4=CC=CC=C4

InChI

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