N-tert-butyl-5-[(5-chloranylquinolin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-tert-butyl-5-[(5-chloranylquinolin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-tert-butyl-5-[(5-chloro-8-quinolyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-tert-butyl-5-[(5-chloro-8-quinolinyl)methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-tert-butyl-5-[(5-chloroquinolin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: tert-butyl-[5-[(5-chloro-8-quinolyl)methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C16H17ClN4S2 MolecularWeight: 364.91598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NN=C(S1)SCC2=C3C(=C(C=C2)Cl)C=CC=N3

Isomeric SMILES

CC(C)(C)NC1=NN=C(S1)SCC2=C3C(=C(C=C2)Cl)C=CC=N3

InChI

InChI=1S/C16H17ClN4S2/c1-16(2,3)19-14-20-21-15(23-14)22-9-10-6-7-12(17)11-5-4-8-18-13(10)11/h4-8H,9H2,1-3H3,(H,19,20)