4,6-dimethyl-2-oxidanylidene-5-[3-oxidanylidene-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propyl]-1H-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-oxidanylidene-5-[3-oxidanylidene-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propyl]-1H-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-oxo-5-[3-oxo-3-[4-(2-thienylsulfonyl)piperazin-1-yl]propyl]-1H-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-oxo-5-[3-oxo-3-(4-thiophen-2-ylsulfonyl-1-piperazinyl)propyl]-1H-pyridine-3-carbonitrile IUPAC Name: 4,6-dimethyl-2-oxo-5-[3-oxo-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propyl]-1H-pyridine-3-carbonitrile Traditional Name: 2-keto-5-[3-keto-3-[4-(2-thienylsulfonyl)piperazino]propyl]-4,6-dimethyl-1H-pyridine-3-carbonitrile Formula: C19H22N4O4S2 MolecularWeight: 434.53238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)C)C#N

InChI

InChI=1S/C19H22N4O4S2/c1-13-15(14(2)21-19(25)16(13)12-20)5-6-17(24)22-7-9-23(10-8-22)29(26,27)18-4-3-11-28-18/h3-4,11H,5-10H2,1-2H3,(H,21,25)