N-(3-ethylpent-1-yn-3-yl)-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-4-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-4-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-4-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-4-(4-methylpiperidino)sulfonyl-benzamide Formula: C20H28N2O3S MolecularWeight: 376.51292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C

InChI

InChI=1S/C20H28N2O3S/c1-5-20(6-2,7-3)21-19(23)17-8-10-18(11-9-17)26(24,25)22-14-12-16(4)13-15-22/h1,8-11,16H,6-7,12-15H2,2-4H3,(H,21,23)