N-[1-[2-(1-methylpiperidin-4-ylidene)hydrazinyl]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-4-nitro-benzamide

Systemtic Name: N-[1-[2-(1-methylpiperidin-4-ylidene)hydrazinyl]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-4-nitro-benzamide Openeye Name: N-[1-(benzylsulfanylmethyl)-2-[2-(1-methyl-4-piperidylidene)hydrazino]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-[1-[2-(1-methyl-4-piperidinylidene)hydrazinyl]-1-oxo-3-(phenylmethylthio)propan-2-yl]-4-nitrobenzamide IUPAC Name: N-[3-benzylsulfanyl-1-[2-(1-methylpiperidin-4-ylidene)hydrazinyl]-1-oxopropan-2-yl]-4-nitrobenzamide Traditional Name: N-[1-[(benzylthio)methyl]-2-keto-2-[N'-(1-methyl-4-piperidylidene)hydrazino]ethyl]-4-nitro-benzamide Formula: C23H27N5O4S MolecularWeight: 469.55658

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(=NNC(=O)C(CSCC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC1

Isomeric SMILES

CN1CCC(=NNC(=O)C(CSCC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC1

InChI

InChI=1S/C23H27N5O4S/c1-27-13-11-19(12-14-27)25-26-23(30)21(16-33-15-17-5-3-2-4-6-17)24-22(29)18-7-9-20(10-8-18)28(31)32/h2-10,21H,11-16H2,1H3,(H,24,29)(H,26,30)