2-methyl-N-[3-(5-methylsulfanyl-1,2,3,4-tetrazol-1-yl)phenyl]-3-nitro-benzamide

Systemtic Name: 2-methyl-N-[3-(5-methylsulfanyl-1,2,3,4-tetrazol-1-yl)phenyl]-3-nitro-benzamide Openeye Name: 2-methyl-N-[3-(5-methylsulfanyltetrazol-1-yl)phenyl]-3-nitro-benzamide CAS Name: 2-methyl-N-[3-[5-(methylthio)-1-tetrazolyl]phenyl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[3-(5-methylsulfanyltetrazol-1-yl)phenyl]-3-nitrobenzamide Traditional Name: 2-methyl-N-[3-[5-(methylthio)tetrazol-1-yl]phenyl]-3-nitro-benzamide Formula: C16H14N6O3S MolecularWeight: 370.38576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=CC(=C2)N3C(=NN=N3)SC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=CC(=C2)N3C(=NN=N3)SC

InChI

InChI=1S/C16H14N6O3S/c1-10-13(7-4-8-14(10)22(24)25)15(23)17-11-5-3-6-12(9-11)21-16(26-2)18-19-20-21/h3-9H,1-2H3,(H,17,23)