1-[(E)-[4-(3,5-dimethylpyridin-1-ium-1-yl)-3-methyl-2-oxidanylidene-1,3-thiazol-5-yl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[4-(3,5-dimethylpyridin-1-ium-1-yl)-3-methyl-2-oxidanylidene-1,3-thiazol-5-yl]methylideneamino]thiourea Openeye Name: [(E)-[4-(3,5-dimethylpyridin-1-ium-1-yl)-3-methyl-2-oxo-thiazol-5-yl]methyleneamino]thiourea CAS Name: [(E)-[4-(3,5-dimethyl-1-pyridin-1-iumyl)-3-methyl-2-oxo-5-thiazolyl]methylideneamino]thiourea IUPAC Name: [(E)-[4-(3,5-dimethylpyridin-1-ium-1-yl)-3-methyl-2-oxo-1,3-thiazol-5-yl]methylideneamino]thiourea Traditional Name: [(E)-[4-(3,5-dimethylpyridin-1-ium-1-yl)-2-keto-3-methyl-4-thiazolin-5-yl]methyleneamino]thiourea Formula: C13H16N5OS2+ MolecularWeight: 322.42904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C[N+](=C1)C2=C(SC(=O)N2C)C=NNC(=S)N)C

Isomeric SMILES

CC1=CC(=C[N+](=C1)C2=C(SC(=O)N2C)/C=N/NC(=S)N)C

InChI

InChI=1S/C13H15N5OS2/c1-8-4-9(2)7-18(6-8)11-10(5-15-16-12(14)20)21-13(19)17(11)3/h4-7H,1-3H3,(H2-,14,16,20)/p+1/b15-5+