N-(3-ethynylphenyl)-2-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-ethynylphenyl)-2-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-ethynylphenyl)-2-(1-piperidylsulfonyl)benzamide CAS Name: N-(3-ethynylphenyl)-2-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(3-ethynylphenyl)-2-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(3-ethynylphenyl)-2-piperidinosulfonyl-benzamide Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2S(=O)(=O)N3CCCCC3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H20N2O3S/c1-2-16-9-8-10-17(15-16)21-20(23)18-11-4-5-12-19(18)26(24,25)22-13-6-3-7-14-22/h1,4-5,8-12,15H,3,6-7,13-14H2,(H,21,23)