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

Systemtic Name: 1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)-1-(3-oxidanylpropyl)thiourea Openeye Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-hydroxypropyl)-3-(m-tolyl)thiourea CAS Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-hydroxypropyl)-3-(3-methylphenyl)thiourea IUPAC Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-hydroxypropyl)-3-(3-methylphenyl)thiourea Traditional Name: 1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-1-(3-hydroxypropyl)-3-(m-tolyl)thiourea Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)C(=S)NC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)C(=S)NC3=CC=CC(=C3)C

InChI

InChI=1S/C23H27N3O3S/c1-3-29-20-8-9-21-17(14-20)13-18(22(28)25-21)15-26(10-5-11-27)23(30)24-19-7-4-6-16(2)12-19/h4,6-9,12-14,27H,3,5,10-11,15H2,1-2H3,(H,24,30)(H,25,28)