4-(benzotriazol-1-ylmethyl)-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-(2-methyl-5-piperidinosulfonyl-phenyl)benzamide Formula: C26H27N5O3S MolecularWeight: 489.58928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C26H27N5O3S/c1-19-9-14-22(35(33,34)30-15-5-2-6-16-30)17-24(19)27-26(32)21-12-10-20(11-13-21)18-31-25-8-4-3-7-23(25)28-29-31/h3-4,7-14,17H,2,5-6,15-16,18H2,1H3,(H,27,32)