N-(3-methylphenyl)-5-(1,2-oxazol-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(3-methylphenyl)-5-(1,2-oxazol-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(isoxazol-3-ylmethylsulfanyl)-N-(m-tolyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-(3-isoxazolylmethylthio)-N-(3-methylphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-methylphenyl)-5-(1,2-oxazol-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-(isoxazol-3-ylmethylthio)-1,3,4-thiadiazol-2-yl]-(m-tolyl)amine Formula: C13H12N4OS2 MolecularWeight: 304.39058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3=NOC=C3

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3=NOC=C3

InChI

InChI=1S/C13H12N4OS2/c1-9-3-2-4-10(7-9)14-12-15-16-13(20-12)19-8-11-5-6-18-17-11/h2-7H,8H2,1H3,(H,14,15)