2-chloranyl-5-[[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]amino]benzenecarbonitrile

Systemtic Name: 2-chloranyl-5-[[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]amino]benzenecarbonitrile Openeye Name: 2-chloro-5-[[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-oxo-ethyl]amino]benzonitrile CAS Name: 2-chloro-5-[[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-oxoethyl]amino]benzonitrile IUPAC Name: 2-chloro-5-[[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxoethyl]amino]benzonitrile Traditional Name: 2-chloro-5-[[2-keto-2-[4-(2-naphthylsulfonyl)piperazino]ethyl]amino]benzonitrile Formula: C23H21ClN4O3S MolecularWeight: 468.95584

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CNC2=CC(=C(C=C2)Cl)C#N)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C(=O)CNC2=CC(=C(C=C2)Cl)C#N)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H21ClN4O3S/c24-22-8-6-20(13-19(22)15-25)26-16-23(29)27-9-11-28(12-10-27)32(30,31)21-7-5-17-3-1-2-4-18(17)14-21/h1-8,13-14,26H,9-12,16H2