(E)-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]carbonyl-3-(4-methylphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]carbonyl-3-(4-methylphenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)-3-(p-tolyl)prop-2-enenitrile CAS Name: (E)-2-[[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-oxomethyl]-3-(4-methylphenyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazine-1-carbonyl]-3-(4-methylphenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)-3-(p-tolyl)acrylonitrile Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C#N)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C24H25N3O3S/c1-18-5-7-19(8-6-18)15-22(17-25)24(28)26-11-13-27(14-12-26)31(29,30)23-10-9-20-3-2-4-21(20)16-23/h5-10,15-16H,2-4,11-14H2,1H3/b22-15+