N-tert-butyl-5-[(1S)-1-(3-nitrophenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-tert-butyl-5-[(1S)-1-(3-nitrophenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-tert-butyl-5-[(1S)-1-(3-nitrophenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-amine CAS Name: N-tert-butyl-5-[[(1S)-1-(3-nitrophenyl)ethyl]thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-tert-butyl-5-[(1S)-1-(3-nitrophenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: tert-butyl-[5-[[(1S)-1-(3-nitrophenyl)ethyl]thio]-1,3,4-thiadiazol-2-yl]amine Formula: C14H18N4O2S2 MolecularWeight: 338.44832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(S2)NC(C)(C)C

Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(S2)NC(C)(C)C

InChI

InChI=1S/C14H18N4O2S2/c1-9(10-6-5-7-11(8-10)18(19)20)21-13-17-16-12(22-13)15-14(2,3)4/h5-9H,1-4H3,(H,15,16)/t9-/m0/s1