N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[1-(p-tolylsulfonyl)-4-piperidyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-2H-benzotriazole-5-carboxamide Traditional Name: N-(1-tosyl-4-piperidyl)-2H-benzotriazole-5-carboxamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC4=NNN=C4C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC4=NNN=C4C=C3

InChI

InChI=1S/C19H21N5O3S/c1-13-2-5-16(6-3-13)28(26,27)24-10-8-15(9-11-24)20-19(25)14-4-7-17-18(12-14)22-23-21-17/h2-7,12,15H,8-11H2,1H3,(H,20,25)(H,21,22,23)