[3,5-dimethyl-4-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethanoylamino]phenyl] thiocyanate

Systemtic Name: [3,5-dimethyl-4-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethanoylamino]phenyl] thiocyanate Openeye Name: [3,5-dimethyl-4-[[2-(4-methylthiazol-2-yl)sulfanylacetyl]amino]phenyl] thiocyanate CAS Name: thiocyanic acid [3,5-dimethyl-4-[[2-[(4-methyl-2-thiazolyl)thio]-1-oxoethyl]amino]phenyl] ester IUPAC Name: [3,5-dimethyl-4-[[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetyl]amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [3,5-dimethyl-4-[[2-[(4-methylthiazol-2-yl)thio]acetyl]amino]phenyl] ester Formula: C15H15N3OS3 MolecularWeight: 349.4941

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)CSC2=NC(=CS2)C)C)SC#N

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)CSC2=NC(=CS2)C)C)SC#N

InChI

InChI=1S/C15H15N3OS3/c1-9-4-12(22-8-16)5-10(2)14(9)18-13(19)7-21-15-17-11(3)6-20-15/h4-6H,7H2,1-3H3,(H,18,19)