N-tert-butyl-5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-tert-butyl-5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-benzylsulfanyl-N-tert-butyl-1,3,4-thiadiazol-2-amine CAS Name: N-tert-butyl-5-(phenylmethylthio)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-benzylsulfanyl-N-tert-butyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-(benzylthio)-1,3,4-thiadiazol-2-yl]-tert-butyl-amine Formula: C13H17N3S2 MolecularWeight: 279.42418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NN=C(S1)SCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC1=NN=C(S1)SCC2=CC=CC=C2

InChI

InChI=1S/C13H17N3S2/c1-13(2,3)14-11-15-16-12(18-11)17-9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,14,15)