1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(furan-2-ylmethyl)thiourea Openeye Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(2-furylmethyl)thiourea CAS Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(2-furanylmethyl)thiourea IUPAC Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(furan-2-ylmethyl)thiourea Traditional Name: 1-(2-furfuryl)-1-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-3-p-phenetyl-thiourea Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC=CO2)CC3=CC4=C(C(=C(C=C4)C)C)NC3=O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC=CO2)CC3=CC4=C(C(=C(C=C4)C)C)NC3=O

InChI

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