N-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]tridecanamide

Systemtic Name: N-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]tridecanamide Openeye Name: N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]tridecanamide CAS Name: N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]tridecanamide IUPAC Name: N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]tridecanamide Traditional Name: N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]tridecanamide Formula: C20H31N5OS MolecularWeight: 389.55804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)NC1=CC=CC(=C1)N2C(=S)N=NN2

Isomeric SMILES

CCCCCCCCCCCCC(=O)NC1=CC=CC(=C1)N2C(=S)N=NN2

InChI

InChI=1S/C20H31N5OS/c1-2-3-4-5-6-7-8-9-10-11-15-19(26)21-17-13-12-14-18(16-17)25-20(27)22-23-24-25/h12-14,16H,2-11,15H2,1H3,(H,21,26)(H,22,24,27)