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

Systemtic Name: N-(3,4-dimethylphenyl)-5-(2-pyridin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-(3,4-dimethylphenyl)-5-[2-(4-pyridyl)ethylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(3,4-dimethylphenyl)-5-(2-pyridin-4-ylethylthio)-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3,4-dimethylphenyl)-5-(2-pyridin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine Traditional Name: (3,4-dimethylphenyl)-[5-[2-(4-pyridyl)ethylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C17H18N4S2 MolecularWeight: 342.48162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCCC3=CC=NC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCCC3=CC=NC=C3)C

InChI

InChI=1S/C17H18N4S2/c1-12-3-4-15(11-13(12)2)19-16-20-21-17(23-16)22-10-7-14-5-8-18-9-6-14/h3-6,8-9,11H,7,10H2,1-2H3,(H,19,20)