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

Systemtic Name: 5-(1,3-benzoxazol-2-ylmethylsulfanyl)-N-(3-methylphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(1,3-benzoxazol-2-ylmethylsulfanyl)-N-(m-tolyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-(1,3-benzoxazol-2-ylmethylthio)-N-(3-methylphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(1,3-benzoxazol-2-ylmethylsulfanyl)-N-(3-methylphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-(1,3-benzoxazol-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]-(m-tolyl)amine Formula: C17H14N4OS2 MolecularWeight: 354.44926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C17H14N4OS2/c1-11-5-4-6-12(9-11)18-16-20-21-17(24-16)23-10-15-19-13-7-2-3-8-14(13)22-15/h2-9H,10H2,1H3,(H,18,20)