5-methyl-1-[1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidin-4-yl]benzotriazole

Systemtic Name: 5-methyl-1-[1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidin-4-yl]benzotriazole Openeye Name: 5-methyl-1-[1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-4-piperidyl]benzotriazole CAS Name: 5-methyl-1-[1-[4-(1-pyrrolidinylsulfonyl)phenyl]sulfonyl-4-piperidinyl]benzotriazole IUPAC Name: 5-methyl-1-[1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidin-4-yl]benzotriazole Traditional Name: 5-methyl-1-[1-(4-pyrrolidinosulfonylphenyl)sulfonyl-4-piperidyl]benzotriazole Formula: C22H27N5O4S2 MolecularWeight: 489.61088

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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)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)N(N=N2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C22H27N5O4S2/c1-17-4-9-22-21(16-17)23-24-27(22)18-10-14-26(15-11-18)33(30,31)20-7-5-19(6-8-20)32(28,29)25-12-2-3-13-25/h4-9,16,18H,2-3,10-15H2,1H3