N-(4-nitrophenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide

Systemtic Name: N-(4-nitrophenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide Openeye Name: N-(4-nitrophenyl)-2-(1-phenyltetrazol-5-yl)sulfanyl-propanamide CAS Name: N-(4-nitrophenyl)-2-[(1-phenyl-5-tetrazolyl)thio]propanamide IUPAC Name: N-(4-nitrophenyl)-2-(1-phenyltetrazol-5-yl)sulfanylpropanamide Traditional Name: N-(4-nitrophenyl)-2-[(1-phenyltetrazol-5-yl)thio]propionamide Formula: C16H14N6O3S MolecularWeight: 370.38576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C16H14N6O3S/c1-11(15(23)17-12-7-9-14(10-8-12)22(24)25)26-16-18-19-20-21(16)13-5-3-2-4-6-13/h2-11H,1H3,(H,17,23)