3,4,5-triethoxy-N-[4-(2-ethoxyphenyl)piperazin-1-yl]carbothioyl-benzamide

Systemtic Name: 3,4,5-triethoxy-N-[4-(2-ethoxyphenyl)piperazin-1-yl]carbothioyl-benzamide Openeye Name: 3,4,5-triethoxy-N-[4-(2-ethoxyphenyl)piperazine-1-carbothioyl]benzamide CAS Name: 3,4,5-triethoxy-N-[[4-(2-ethoxyphenyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[4-(2-ethoxyphenyl)piperazine-1-carbothioyl]benzamide Traditional Name: 3,4,5-triethoxy-N-(4-o-phenetylpiperazine-1-carbothioyl)benzamide Formula: C26H35N3O5S MolecularWeight: 501.6382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NC(=O)C3=CC(=C(C(=C3)OCC)OCC)OCC

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NC(=O)C3=CC(=C(C(=C3)OCC)OCC)OCC

InChI

InChI=1S/C26H35N3O5S/c1-5-31-21-12-10-9-11-20(21)28-13-15-29(16-14-28)26(35)27-25(30)19-17-22(32-6-2)24(34-8-4)23(18-19)33-7-3/h9-12,17-18H,5-8,13-16H2,1-4H3,(H,27,30,35)