1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(2-thienylmethyl)thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-ethoxyphenyl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-3-p-phenetyl-1-(2-thenyl)thiourea Formula: C26H27N3O4S2 MolecularWeight: 509.64028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC=CS2)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC=CS2)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC

InChI

InChI=1S/C26H27N3O4S2/c1-4-33-20-9-7-19(8-10-20)27-26(34)29(16-21-6-5-11-35-21)15-18-12-17-13-23(31-2)24(32-3)14-22(17)28-25(18)30/h5-14H,4,15-16H2,1-3H3,(H,27,34)(H,28,30)