N-[3-[[5-(2-cyano-4-nitro-phenyl)sulfanyl-1,3,4-thiadiazol-2-yl]amino]phenyl]ethanamide

Systemtic Name: N-[3-[[5-(2-cyano-4-nitro-phenyl)sulfanyl-1,3,4-thiadiazol-2-yl]amino]phenyl]ethanamide Openeye Name: N-[3-[[5-(2-cyano-4-nitro-phenyl)sulfanyl-1,3,4-thiadiazol-2-yl]amino]phenyl]acetamide CAS Name: N-[3-[[5-[(2-cyano-4-nitrophenyl)thio]-1,3,4-thiadiazol-2-yl]amino]phenyl]acetamide IUPAC Name: N-[3-[[5-(2-cyano-4-nitrophenyl)sulfanyl-1,3,4-thiadiazol-2-yl]amino]phenyl]acetamide Traditional Name: N-[3-[[5-[(2-cyano-4-nitro-phenyl)thio]-1,3,4-thiadiazol-2-yl]amino]phenyl]acetamide Formula: C17H12N6O3S2 MolecularWeight: 412.44558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC2=NN=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC2=NN=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H12N6O3S2/c1-10(24)19-12-3-2-4-13(8-12)20-16-21-22-17(28-16)27-15-6-5-14(23(25)26)7-11(15)9-18/h2-8H,1H3,(H,19,24)(H,20,21)