3,5-bis(2-oxidanylidenepropylsulfanyl)-1,2-thiazole-4-carbonitrile

Systemtic Name: 3,5-bis(2-oxidanylidenepropylsulfanyl)-1,2-thiazole-4-carbonitrile Openeye Name: 3,5-bis(acetonylsulfanyl)isothiazole-4-carbonitrile CAS Name: 3,5-bis(2-oxopropylthio)-4-isothiazolecarbonitrile IUPAC Name: 3,5-bis(2-oxopropylsulfanyl)-1,2-thiazole-4-carbonitrile Traditional Name: 3,5-bis(acetonylthio)isothiazole-4-carbonitrile Formula: C10H10N2O2S3 MolecularWeight: 286.3936

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=C(C(=NS1)SCC(=O)C)C#N

Isomeric SMILES

CC(=O)CSC1=C(C(=NS1)SCC(=O)C)C#N

InChI

InChI=1S/C10H10N2O2S3/c1-6(13)4-15-9-8(3-11)10(17-12-9)16-5-7(2)14/h4-5H2,1-2H3