N-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-methyl-4-oxidanylidene-1,3-thiazolidin-3-yl]-4-nitro-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-methyl-4-oxidanylidene-1,3-thiazolidin-3-yl]-4-nitro-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-methyl-4-oxo-thiazolidin-3-yl]-4-nitro-benzamide CAS Name: N-[2-[(1,3-benzothiazol-2-ylthio)methyl]-2-methyl-4-oxo-3-thiazolidinyl]-4-nitrobenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-methyl-4-oxo-1,3-thiazolidin-3-yl]-4-nitrobenzamide Traditional Name: N-[2-[(1,3-benzothiazol-2-ylthio)methyl]-4-keto-2-methyl-thiazolidin-3-yl]-4-nitro-benzamide Formula: C19H16N4O4S3 MolecularWeight: 460.54974

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C(=O)CS1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1(N(C(=O)CS1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H16N4O4S3/c1-19(11-28-18-20-14-4-2-3-5-15(14)30-18)22(16(24)10-29-19)21-17(25)12-6-8-13(9-7-12)23(26)27/h2-9H,10-11H2,1H3,(H,21,25)