N-(2,3-dimethylphenyl)-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(2,3-dimethylphenyl)-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-(2,3-dimethylphenyl)-5-(3-pyridylmethylsulfanyl)-1,3,4-thiadiazol-2-amine CAS Name: N-(2,3-dimethylphenyl)-5-(3-pyridinylmethylthio)-1,3,4-thiadiazol-2-amine IUPAC Name: N-(2,3-dimethylphenyl)-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Traditional Name: (2,3-dimethylphenyl)-[5-(3-pyridylmethylthio)-1,3,4-thiadiazol-2-yl]amine Formula: C16H16N4S2 MolecularWeight: 328.45504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N4S2/c1-11-5-3-7-14(12(11)2)18-15-19-20-16(22-15)21-10-13-6-4-8-17-9-13/h3-9H,10H2,1-2H3,(H,18,19)