N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(1,2,3,4-tetrazol-1-yl)benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(1,2,3,4-tetrazol-1-yl)benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(tetrazol-1-yl)benzamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-3-(1-tetrazolyl)benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(tetrazol-1-yl)benzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(tetrazol-1-yl)benzamide Formula: C20H22N6O3S MolecularWeight: 426.49208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)N4C=NN=N4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)N4C=NN=N4

InChI

InChI=1S/C20H22N6O3S/c27-20(16-7-5-9-18(13-16)26-15-21-23-24-26)22-17-8-6-10-19(14-17)30(28,29)25-11-3-1-2-4-12-25/h5-10,13-15H,1-4,11-12H2,(H,22,27)