N-[4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-2-naphthalen-2-ylsulfonyl-ethanamide

Systemtic Name: N-[4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-2-naphthalen-2-ylsulfonyl-ethanamide Openeye Name: N-[4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-2-(2-naphthylsulfonyl)acetamide CAS Name: N-[4-[4-(2,2-dimethyl-1-oxopropyl)-1-piperazinyl]phenyl]-2-(2-naphthalenylsulfonyl)acetamide IUPAC Name: N-[4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-2-naphthalen-2-ylsulfonylacetamide Traditional Name: 2-(2-naphthylsulfonyl)-N-[4-(4-pivaloylpiperazino)phenyl]acetamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)(C)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H31N3O4S/c1-27(2,3)26(32)30-16-14-29(15-17-30)23-11-9-22(10-12-23)28-25(31)19-35(33,34)24-13-8-20-6-4-5-7-21(20)18-24/h4-13,18H,14-17,19H2,1-3H3,(H,28,31)