4-[5-[(3-nitrophenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]benzamide

Systemtic Name: 4-[5-[(3-nitrophenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]benzamide Openeye Name: 4-[5-[(3-nitrophenyl)methylsulfanyl]tetrazol-1-yl]benzamide CAS Name: 4-[5-[(3-nitrophenyl)methylthio]-1-tetrazolyl]benzamide IUPAC Name: 4-[5-[(3-nitrophenyl)methylsulfanyl]tetrazol-1-yl]benzamide Traditional Name: 4-[5-[(3-nitrobenzyl)thio]tetrazol-1-yl]benzamide Formula: C15H12N6O3S MolecularWeight: 356.35918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NN=NN2C3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NN=NN2C3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C15H12N6O3S/c16-14(22)11-4-6-12(7-5-11)20-15(17-18-19-20)25-9-10-2-1-3-13(8-10)21(23)24/h1-8H,9H2,(H2,16,22)