N-(3-nitro-4-piperazin-1-yl-phenyl)-2-phenylsulfanyl-ethanamide

Systemtic Name: N-(3-nitro-4-piperazin-1-yl-phenyl)-2-phenylsulfanyl-ethanamide Openeye Name: N-(3-nitro-4-piperazin-1-yl-phenyl)-2-phenylsulfanyl-acetamide CAS Name: N-[3-nitro-4-(1-piperazinyl)phenyl]-2-(phenylthio)acetamide IUPAC Name: N-(3-nitro-4-piperazin-1-ylphenyl)-2-phenylsulfanylacetamide Traditional Name: N-(3-nitro-4-piperazino-phenyl)-2-(phenylthio)acetamide Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)NC(=O)CSC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)NC(=O)CSC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O3S/c23-18(13-26-15-4-2-1-3-5-15)20-14-6-7-16(17(12-14)22(24)25)21-10-8-19-9-11-21/h1-7,12,19H,8-11,13H2,(H,20,23)