N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[4-(3,5-dimethylpiperidino)sulfonylphenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4C=NC=N4)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4C=NC=N4)C

InChI

InChI=1S/C23H27N5O3S/c1-17-11-18(2)13-28(12-17)32(30,31)22-9-7-21(8-10-22)26-23(29)20-5-3-19(4-6-20)14-27-16-24-15-25-27/h3-10,15-18H,11-14H2,1-2H3,(H,26,29)