N-tert-butyl-5-(5-nitroquinolin-8-yl)sulfanyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-tert-butyl-5-(5-nitroquinolin-8-yl)sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-tert-butyl-5-[(5-nitro-8-quinolyl)sulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-tert-butyl-5-[(5-nitro-8-quinolinyl)thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-tert-butyl-5-(5-nitroquinolin-8-yl)sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: tert-butyl-[5-[(5-nitro-8-quinolyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C15H15N5O2S2 MolecularWeight: 361.4419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NN=C(S1)SC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

Isomeric SMILES

CC(C)(C)NC1=NN=C(S1)SC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

InChI

InChI=1S/C15H15N5O2S2/c1-15(2,3)17-13-18-19-14(24-13)23-11-7-6-10(20(21)22)9-5-4-8-16-12(9)11/h4-8H,1-3H3,(H,17,18)