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

Systemtic Name: N-(2-nitrophenyl)-2-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: 2-(1-isopropyltetrazol-5-yl)sulfanyl-N-(2-nitrophenyl)acetamide CAS Name: N-(2-nitrophenyl)-2-[(1-propan-2-yl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(2-nitrophenyl)-2-(1-propan-2-yltetrazol-5-yl)sulfanylacetamide Traditional Name: 2-[(1-isopropyltetrazol-5-yl)thio]-N-(2-nitrophenyl)acetamide Formula: C12H14N6O3S MolecularWeight: 322.34296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=N1)SCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C(=NN=N1)SCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H14N6O3S/c1-8(2)17-12(14-15-16-17)22-7-11(19)13-9-5-3-4-6-10(9)18(20)21/h3-6,8H,7H2,1-2H3,(H,13,19)