N-[4-(cyanomethyl)phenyl]-2-methoxy-5-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-5-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-5-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-5-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-5-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-5-(4-methylpiperidino)sulfonyl-benzamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C22H25N3O4S/c1-16-10-13-25(14-11-16)30(27,28)19-7-8-21(29-2)20(15-19)22(26)24-18-5-3-17(4-6-18)9-12-23/h3-8,15-16H,9-11,13-14H2,1-2H3,(H,24,26)