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

Systemtic Name: 1-[(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]-3-(2-nitrophenyl)propan-2-one Openeye Name: 1-[1-(1-naphthyl)tetrazol-5-yl]sulfanyl-3-(2-nitrophenyl)propan-2-one CAS Name: 1-[[1-(1-naphthalenyl)-5-tetrazolyl]thio]-3-(2-nitrophenyl)-2-propanone IUPAC Name: 1-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-3-(2-nitrophenyl)propan-2-one Traditional Name: 1-[[1-(1-naphthyl)tetrazol-5-yl]thio]-3-(2-nitrophenyl)acetone Formula: C20H15N5O3S MolecularWeight: 405.4298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N3C(=NN=N3)SCC(=O)CC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N3C(=NN=N3)SCC(=O)CC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O3S/c26-16(12-15-7-2-4-10-18(15)25(27)28)13-29-20-21-22-23-24(20)19-11-5-8-14-6-1-3-9-17(14)19/h1-11H,12-13H2