2-azanyl-4-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-6-thioxo-1H-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-[4-(4-methylpiperazino)sulfonylphenyl]-6-thioxo-1H-pyridine-3,5-dicarbonitrile Formula: C18H18N6O2S2 MolecularWeight: 414.50452

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=C(C(=S)NC(=C3C#N)N)C#N

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=C(C(=S)NC(=C3C#N)N)C#N

InChI

InChI=1S/C18H18N6O2S2/c1-23-6-8-24(9-7-23)28(25,26)13-4-2-12(3-5-13)16-14(10-19)17(21)22-18(27)15(16)11-20/h2-5H,6-9H2,1H3,(H3,21,22,27)