N-(3-methylbutyl)-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(3-methylbutyl)-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: N-isopentyl-2-(4-tetralin-6-ylsulfonylpiperazin-1-yl)acetamide CAS Name: N-(3-methylbutyl)-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]acetamide IUPAC Name: N-(3-methylbutyl)-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]acetamide Traditional Name: N-isoamyl-2-(4-tetralin-6-ylsulfonylpiperazino)acetamide Formula: C21H33N3O3S MolecularWeight: 407.57002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC3=C(CCCC3)C=C2

Isomeric SMILES

CC(C)CCNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC3=C(CCCC3)C=C2

InChI

InChI=1S/C21H33N3O3S/c1-17(2)9-10-22-21(25)16-23-11-13-24(14-12-23)28(26,27)20-8-7-18-5-3-4-6-19(18)15-20/h7-8,15,17H,3-6,9-14,16H2,1-2H3,(H,22,25)