N-[1-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-4-nitro-benzamide

Systemtic Name: N-[1-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-4-nitro-benzamide Openeye Name: N-[1-(benzylsulfanylmethyl)-2-[(2E)-2-(2-furylmethylene)hydrazino]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-[1-[(2E)-2-(2-furanylmethylidene)hydrazinyl]-1-oxo-3-(phenylmethylthio)propan-2-yl]-4-nitrobenzamide IUPAC Name: N-[3-benzylsulfanyl-1-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-1-oxopropan-2-yl]-4-nitrobenzamide Traditional Name: N-[1-[(benzylthio)methyl]-2-[(N'E)-N'-(2-furfurylidene)hydrazino]-2-keto-ethyl]-4-nitro-benzamide Formula: C22H20N4O5S MolecularWeight: 452.483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(C(=O)NN=CC2=CC=CO2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSCC(C(=O)N/N=C/C2=CC=CO2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O5S/c27-21(17-8-10-18(11-9-17)26(29)30)24-20(15-32-14-16-5-2-1-3-6-16)22(28)25-23-13-19-7-4-12-31-19/h1-13,20H,14-15H2,(H,24,27)(H,25,28)/b23-13+