2-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[(1,1-dioxothian-4-yl)amino]-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[(1,1-dioxo-4-thianyl)amino]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[(1,1-dioxothian-4-yl)amino]-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[(1,1-diketothian-4-yl)amino]-4,6-dimethyl-nicotinonitrile Formula: C13H17N3O2S MolecularWeight: 279.35798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)NC2CCS(=O)(=O)CC2)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)NC2CCS(=O)(=O)CC2)C

InChI

InChI=1S/C13H17N3O2S/c1-9-7-10(2)15-13(12(9)8-14)16-11-3-5-19(17,18)6-4-11/h7,11H,3-6H2,1-2H3,(H,15,16)