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

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-chloro-3-nitro-phenyl)acetamide CAS Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-N-(4-chloro-3-nitrophenyl)acetamide IUPAC Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-chloro-3-nitrophenyl)acetamide Traditional Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-N-(4-chloro-3-nitro-phenyl)acetamide Formula: C16H12ClN5O3S2 MolecularWeight: 421.88118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN5O3S2/c17-12-7-6-11(8-13(12)22(24)25)18-14(23)9-26-16-21-20-15(27-16)19-10-4-2-1-3-5-10/h1-8H,9H2,(H,18,23)(H,19,20)