1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]-3-p-phenetyl-1-(3-pyridylmethyl)thiourea Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CN=CC=C2)CC3=CC4=CC(=C(C=C4NC3=O)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CN=CC=C2)CC3=CC4=CC(=C(C=C4NC3=O)C)C

InChI

InChI=1S/C27H28N4O2S/c1-4-33-24-9-7-23(8-10-24)29-27(34)31(16-20-6-5-11-28-15-20)17-22-14-21-12-18(2)19(3)13-25(21)30-26(22)32/h5-15H,4,16-17H2,1-3H3,(H,29,34)(H,30,32)