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

Systemtic Name: 3,4,5-triethoxy-N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioyl-benzamide Openeye Name: 3,4,5-triethoxy-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]benzamide CAS Name: 3,4,5-triethoxy-N-[[4-(4-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]benzamide Traditional Name: 3,4,5-triethoxy-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]benzamide Formula: C24H30N4O6S MolecularWeight: 502.5832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H30N4O6S/c1-4-32-20-15-17(16-21(33-5-2)22(20)34-6-3)23(29)25-24(35)27-13-11-26(12-14-27)18-7-9-19(10-8-18)28(30)31/h7-10,15-16H,4-6,11-14H2,1-3H3,(H,25,29,35)