5-methyl-1-[1-[3-methyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylpiperidin-4-yl]benzotriazole

Systemtic Name: 5-methyl-1-[1-[3-methyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylpiperidin-4-yl]benzotriazole Openeye Name: 5-methyl-1-[1-[3-methyl-4-(tetrazol-1-yl)phenyl]sulfonyl-4-piperidyl]benzotriazole CAS Name: 5-methyl-1-[1-[3-methyl-4-(1-tetrazolyl)phenyl]sulfonyl-4-piperidinyl]benzotriazole IUPAC Name: 5-methyl-1-[1-[3-methyl-4-(tetrazol-1-yl)phenyl]sulfonylpiperidin-4-yl]benzotriazole Traditional Name: 5-methyl-1-[1-[3-methyl-4-(tetrazol-1-yl)phenyl]sulfonyl-4-piperidyl]benzotriazole Formula: C20H22N8O2S MolecularWeight: 438.50608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(N=N2)C3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)N5C=NN=N5)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(N=N2)C3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)N5C=NN=N5)C

InChI

InChI=1S/C20H22N8O2S/c1-14-3-5-20-18(11-14)22-24-28(20)16-7-9-26(10-8-16)31(29,30)17-4-6-19(15(2)12-17)27-13-21-23-25-27/h3-6,11-13,16H,7-10H2,1-2H3