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

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)-1-(3-oxidanylpropyl)thiourea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-hydroxypropyl)-3-(m-tolyl)thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-hydroxypropyl)-3-(3-methylphenyl)thiourea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-hydroxypropyl)-3-(3-methylphenyl)thiourea Traditional Name: 1-(3-hydroxypropyl)-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-3-(m-tolyl)thiourea Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O4S/c1-15-6-4-7-18(10-15)24-23(31)26(8-5-9-27)14-17-11-16-12-20(29-2)21(30-3)13-19(16)25-22(17)28/h4,6-7,10-13,27H,5,8-9,14H2,1-3H3,(H,24,31)(H,25,28)