(5Z)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-methylsulfanyl-1,3-thiazol-3-ium-4-one

Systemtic Name: (5Z)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-methylsulfanyl-1,3-thiazol-3-ium-4-one Openeye Name: (5Z)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-methylsulfanyl-thiazol-3-ium-4-one CAS Name: (5Z)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-(methylthio)-4-thiazol-3-iumone IUPAC Name: (5Z)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-methylsulfanyl-1,3-thiazol-3-ium-4-one Traditional Name: (5Z)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-(methylthio)-2-thiazolin-3-ium-4-one Formula: C14H15N2OS3+ MolecularWeight: 323.4767

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC(=C2N(C3=CC=CC=C3S2)C)C1=O)SC

Isomeric SMILES

CC[N+]1=C(S/C(=C\2/N(C3=CC=CC=C3S2)C)/C1=O)SC

InChI

InChI=1S/C14H15N2OS3/c1-4-16-12(17)11(20-14(16)18-3)13-15(2)9-7-5-6-8-10(9)19-13/h5-8H,4H2,1-3H3/q+1/b13-11-