N-(3-methoxyphenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(3-methoxyphenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-(3-methoxyphenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(3-methoxyphenyl)-5-[[4-(1-pyrazolyl)phenyl]methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-methoxyphenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: (3-methoxyphenyl)-[5-[(4-pyrazol-1-ylbenzyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C19H17N5OS2 MolecularWeight: 395.50118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NN=C(S2)SCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NN=C(S2)SCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C19H17N5OS2/c1-25-17-5-2-4-15(12-17)21-18-22-23-19(27-18)26-13-14-6-8-16(9-7-14)24-11-3-10-20-24/h2-12H,13H2,1H3,(H,21,22)