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

Systemtic Name: 2-[1-[3-methyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylpiperidin-3-yl]benzotriazole Openeye Name: 2-[1-[3-methyl-4-(tetrazol-1-yl)phenyl]sulfonyl-3-piperidyl]benzotriazole CAS Name: 2-[1-[3-methyl-4-(1-tetrazolyl)phenyl]sulfonyl-3-piperidinyl]benzotriazole IUPAC Name: 2-[1-[3-methyl-4-(tetrazol-1-yl)phenyl]sulfonylpiperidin-3-yl]benzotriazole Traditional Name: 2-[1-[3-methyl-4-(tetrazol-1-yl)phenyl]sulfonyl-3-piperidyl]benzotriazole Formula: C19H20N8O2S MolecularWeight: 424.4795

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC(C2)N3N=C4C=CC=CC4=N3)N5C=NN=N5

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC(C2)N3N=C4C=CC=CC4=N3)N5C=NN=N5

InChI

InChI=1S/C19H20N8O2S/c1-14-11-16(8-9-19(14)26-13-20-23-24-26)30(28,29)25-10-4-5-15(12-25)27-21-17-6-2-3-7-18(17)22-27/h2-3,6-9,11,13,15H,4-5,10,12H2,1H3