N-(3-cyanophenyl)-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-cyanophenyl)-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-cyanophenyl)-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-(3-cyanophenyl)-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(3-cyanophenyl)-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(3-cyanophenyl)-2-methyl-5-piperidinosulfonyl-benzamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H21N3O3S/c1-15-8-9-18(27(25,26)23-10-3-2-4-11-23)13-19(15)20(24)22-17-7-5-6-16(12-17)14-21/h5-9,12-13H,2-4,10-11H2,1H3,(H,22,24)