N-[4-[4-(3-bromophenyl)carbonylpiperazin-1-yl]phenyl]-2-naphthalen-2-ylsulfonyl-ethanamide

Systemtic Name: N-[4-[4-(3-bromophenyl)carbonylpiperazin-1-yl]phenyl]-2-naphthalen-2-ylsulfonyl-ethanamide Openeye Name: N-[4-[4-(3-bromobenzoyl)piperazin-1-yl]phenyl]-2-(2-naphthylsulfonyl)acetamide CAS Name: N-[4-[4-[(3-bromophenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-(2-naphthalenylsulfonyl)acetamide IUPAC Name: N-[4-[4-(3-bromobenzoyl)piperazin-1-yl]phenyl]-2-naphthalen-2-ylsulfonylacetamide Traditional Name: N-[4-[4-(3-bromobenzoyl)piperazino]phenyl]-2-(2-naphthylsulfonyl)acetamide Formula: C29H26BrN3O4S MolecularWeight: 592.50344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(=O)C5=CC(=CC=C5)Br

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(=O)C5=CC(=CC=C5)Br

InChI

InChI=1S/C29H26BrN3O4S/c30-24-7-3-6-23(18-24)29(35)33-16-14-32(15-17-33)26-11-9-25(10-12-26)31-28(34)20-38(36,37)27-13-8-21-4-1-2-5-22(21)19-27/h1-13,18-19H,14-17,20H2,(H,31,34)