1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-phenyl-thiourea

Systemtic Name: 1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-phenyl-thiourea Openeye Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-phenyl-thiourea CAS Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-phenylthiourea IUPAC Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[(4-methoxyphenyl)methyl]-3-phenylthiourea Traditional Name: 1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-1-p-anisyl-3-phenyl-thiourea Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=C(C=C3)OC)C(=S)NC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=C(C=C3)OC)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2S/c1-3-19-11-14-25-21(15-19)16-22(26(31)29-25)18-30(17-20-9-12-24(32-2)13-10-20)27(33)28-23-7-5-4-6-8-23/h4-16H,3,17-18H2,1-2H3,(H,28,33)(H,29,31)