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

Systemtic Name: N-(3-ethynylphenyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-ethynylphenyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(3-ethynylphenyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(3-ethynylphenyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(3-ethynylphenyl)-3-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=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

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

InChI

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