1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(furan-2-ylmethyl)thiourea Openeye Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(2-furylmethyl)thiourea CAS Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(2-furanylmethyl)thiourea IUPAC Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(furan-2-ylmethyl)thiourea Traditional Name: 1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(2-furfuryl)thiourea Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CC2=CC=CO2)CC3=CC4=C(C=CC(=C4)OCC)NC3=O

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CC2=CC=CO2)CC3=CC4=C(C=CC(=C4)OCC)NC3=O

InChI

InChI=1S/C26H27N3O3S/c1-3-18-8-5-6-10-23(18)28-26(33)29(17-22-9-7-13-32-22)16-20-14-19-15-21(31-4-2)11-12-24(19)27-25(20)30/h5-15H,3-4,16-17H2,1-2H3,(H,27,30)(H,28,33)