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

Systemtic Name: N-phenyl-5-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-phenyl-5-[(1-propyltetrazol-5-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-phenyl-5-[(1-propyl-5-tetrazolyl)methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-phenyl-5-[(1-propyltetrazol-5-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: phenyl-[5-[(1-propyltetrazol-5-yl)methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C13H15N7S2 MolecularWeight: 333.4351

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)CSC2=NN=C(S2)NC3=CC=CC=C3

Isomeric SMILES

CCCN1C(=NN=N1)CSC2=NN=C(S2)NC3=CC=CC=C3

InChI

InChI=1S/C13H15N7S2/c1-2-8-20-11(15-18-19-20)9-21-13-17-16-12(22-13)14-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,14,16)