5-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-N-phenyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-N-phenyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(1-butyltetrazol-5-yl)methylsulfanyl]-N-phenyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(1-butyl-5-tetrazolyl)methylthio]-N-phenyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(1-butyltetrazol-5-yl)methylsulfanyl]-N-phenyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(1-butyltetrazol-5-yl)methylthio]-1,3,4-thiadiazol-2-yl]-phenyl-amine Formula: C14H17N7S2 MolecularWeight: 347.46168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CSC2=NN=C(S2)NC3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=NN=N1)CSC2=NN=C(S2)NC3=CC=CC=C3

InChI

InChI=1S/C14H17N7S2/c1-2-3-9-21-12(16-19-20-21)10-22-14-18-17-13(23-14)15-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,15,17)