1-(4-methylphenyl)sulfonyl-N-(2-phenylbenzotriazol-5-yl)piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-(2-phenylbenzotriazol-5-yl)piperidine-4-carboxamide Openeye Name: N-(2-phenylbenzotriazol-5-yl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-(2-phenyl-5-benzotriazolyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-(2-phenylbenzotriazol-5-yl)piperidine-4-carboxamide Traditional Name: N-(2-phenylbenzotriazol-5-yl)-1-tosyl-isonipecotamide Formula: C25H25N5O3S MolecularWeight: 475.5627

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=NN(N=C4C=C3)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=NN(N=C4C=C3)C5=CC=CC=C5

InChI

InChI=1S/C25H25N5O3S/c1-18-7-10-22(11-8-18)34(32,33)29-15-13-19(14-16-29)25(31)26-20-9-12-23-24(17-20)28-30(27-23)21-5-3-2-4-6-21/h2-12,17,19H,13-16H2,1H3,(H,26,31)