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

Systemtic Name: 2-[(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[1-(1-naphthyl)tetrazol-5-yl]sulfanyl-N-(4-nitrophenyl)acetamide CAS Name: 2-[[1-(1-naphthalenyl)-5-tetrazolyl]thio]-N-(4-nitrophenyl)acetamide IUPAC Name: 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-(4-nitrophenyl)acetamide Traditional Name: 2-[[1-(1-naphthyl)tetrazol-5-yl]thio]-N-(4-nitrophenyl)acetamide Formula: C19H14N6O3S MolecularWeight: 406.41786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N3C(=NN=N3)SCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N3C(=NN=N3)SCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N6O3S/c26-18(20-14-8-10-15(11-9-14)25(27)28)12-29-19-21-22-23-24(19)17-7-3-5-13-4-1-2-6-16(13)17/h1-11H,12H2,(H,20,26)