2-chloranyl-5-[[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]amino]benzenecarbonitrile

Systemtic Name: 2-chloranyl-5-[[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]amino]benzenecarbonitrile Openeye Name: 2-chloro-5-[[2-(4-indan-5-ylsulfonylpiperazin-1-yl)-2-oxo-ethyl]amino]benzonitrile CAS Name: 2-chloro-5-[[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-2-oxoethyl]amino]benzonitrile IUPAC Name: 2-chloro-5-[[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxoethyl]amino]benzonitrile Traditional Name: 2-chloro-5-[[2-(4-indan-5-ylsulfonylpiperazino)-2-keto-ethyl]amino]benzonitrile Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CNC4=CC(=C(C=C4)Cl)C#N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CNC4=CC(=C(C=C4)Cl)C#N

InChI

InChI=1S/C22H23ClN4O3S/c23-21-7-5-19(12-18(21)14-24)25-15-22(28)26-8-10-27(11-9-26)31(29,30)20-6-4-16-2-1-3-17(16)13-20/h4-7,12-13,25H,1-3,8-11,15H2