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

Systemtic Name: 3-[[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]amino]benzenecarbonitrile Openeye Name: 3-[[2-(4-indan-5-ylsulfonylpiperazin-1-yl)-2-oxo-ethyl]amino]benzonitrile CAS Name: 3-[[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-2-oxoethyl]amino]benzonitrile IUPAC Name: 3-[[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxoethyl]amino]benzonitrile Traditional Name: 3-[[2-(4-indan-5-ylsulfonylpiperazino)-2-keto-ethyl]amino]benzonitrile Formula: C22H24N4O3S MolecularWeight: 424.51596

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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=CC(=C4)C#N

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3S/c23-15-17-3-1-6-20(13-17)24-16-22(27)25-9-11-26(12-10-25)30(28,29)21-8-7-18-4-2-5-19(18)14-21/h1,3,6-8,13-14,24H,2,4-5,9-12,16H2