N-(2-methoxyethyl)-2-[2-[4-(2-nitrophenyl)piperazin-1-yl]carbonylphenyl]sulfanyl-ethanamide

Systemtic Name: N-(2-methoxyethyl)-2-[2-[4-(2-nitrophenyl)piperazin-1-yl]carbonylphenyl]sulfanyl-ethanamide Openeye Name: N-(2-methoxyethyl)-2-[2-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenyl]sulfanyl-acetamide CAS Name: N-(2-methoxyethyl)-2-[[2-[[4-(2-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]thio]acetamide IUPAC Name: N-(2-methoxyethyl)-2-[2-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenyl]sulfanylacetamide Traditional Name: N-(2-methoxyethyl)-2-[[2-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenyl]thio]acetamide Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COCCNC(=O)CSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O5S/c1-31-15-10-23-21(27)16-32-20-9-5-2-6-17(20)22(28)25-13-11-24(12-14-25)18-7-3-4-8-19(18)26(29)30/h2-9H,10-16H2,1H3,(H,23,27)