4-(4-methylpiperidin-1-yl)-3-nitro-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]benzamide

Systemtic Name: 4-(4-methylpiperidin-1-yl)-3-nitro-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]benzamide Openeye Name: 4-(4-methyl-1-piperidyl)-3-nitro-N-[2-(2-thienylmethylsulfanyl)ethyl]benzamide CAS Name: 4-(4-methyl-1-piperidinyl)-3-nitro-N-[2-(thiophen-2-ylmethylthio)ethyl]benzamide IUPAC Name: 4-(4-methylpiperidin-1-yl)-3-nitro-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]benzamide Traditional Name: 4-(4-methylpiperidino)-3-nitro-N-[2-(2-thenylthio)ethyl]benzamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCCSCC3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCCSCC3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O3S2/c1-15-6-9-22(10-7-15)18-5-4-16(13-19(18)23(25)26)20(24)21-8-12-27-14-17-3-2-11-28-17/h2-5,11,13,15H,6-10,12,14H2,1H3,(H,21,24)