N-(3-chloranyl-4-methyl-phenyl)-5-(pyridin-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-5-(pyridin-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-(3-chloro-4-methyl-phenyl)-5-(2-pyridylmethylsulfanyl)-1,3,4-thiadiazol-2-amine CAS Name: N-(3-chloro-4-methylphenyl)-5-(2-pyridinylmethylthio)-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-chloro-4-methylphenyl)-5-(pyridin-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Traditional Name: (3-chloro-4-methyl-phenyl)-[5-(2-pyridylmethylthio)-1,3,4-thiadiazol-2-yl]amine Formula: C15H13ClN4S2 MolecularWeight: 348.87352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCC3=CC=CC=N3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCC3=CC=CC=N3)Cl

InChI

InChI=1S/C15H13ClN4S2/c1-10-5-6-11(8-13(10)16)18-14-19-20-15(22-14)21-9-12-4-2-3-7-17-12/h2-8H,9H2,1H3,(H,18,19)