1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(3-methylphenyl)thiourea

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(3-methylphenyl)thiourea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(m-tolyl)thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(3-methylphenyl)thiourea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(3-methylphenyl)thiourea Traditional Name: 1-(2-hydroxyethyl)-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-3-(m-tolyl)thiourea Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N(CCO)CC2=CC3=CC(=C(C=C3NC2=O)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N(CCO)CC2=CC3=CC(=C(C=C3NC2=O)OC)OC

InChI

InChI=1S/C22H25N3O4S/c1-14-5-4-6-17(9-14)23-22(30)25(7-8-26)13-16-10-15-11-19(28-2)20(29-3)12-18(15)24-21(16)27/h4-6,9-12,26H,7-8,13H2,1-3H3,(H,23,30)(H,24,27)