2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-phenoxyphenyl)ethanone

Systemtic Name: 2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-phenoxyphenyl)ethanone Openeye Name: 2-(1-cyclopropyltetrazol-5-yl)sulfanyl-1-(4-phenoxyphenyl)ethanone CAS Name: 2-[(1-cyclopropyl-5-tetrazolyl)thio]-1-(4-phenoxyphenyl)ethanone IUPAC Name: 2-(1-cyclopropyltetrazol-5-yl)sulfanyl-1-(4-phenoxyphenyl)ethanone Traditional Name: 2-[(1-cyclopropyltetrazol-5-yl)thio]-1-(4-phenoxyphenyl)ethanone Formula: C18H16N4O2S MolecularWeight: 352.41024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)SCC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CC1N2C(=NN=N2)SCC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C18H16N4O2S/c23-17(12-25-18-19-20-21-22(18)14-8-9-14)13-6-10-16(11-7-13)24-15-4-2-1-3-5-15/h1-7,10-11,14H,8-9,12H2