N-[5-chloranyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-4-nitro-benzamide

Systemtic Name: N-[5-chloranyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-4-nitro-benzamide Openeye Name: N-[5-chloro-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-4-nitro-benzamide CAS Name: N-[5-chloro-2-[(4-methyl-1,2,4-triazol-3-yl)thio]phenyl]-4-nitrobenzamide IUPAC Name: N-[5-chloro-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-4-nitrobenzamide Traditional Name: N-[5-chloro-2-[(4-methyl-1,2,4-triazol-3-yl)thio]phenyl]-4-nitro-benzamide Formula: C16H12ClN5O3S MolecularWeight: 389.81618

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=C(C=C(C=C2)Cl)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NN=C1SC2=C(C=C(C=C2)Cl)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN5O3S/c1-21-9-18-20-16(21)26-14-7-4-11(17)8-13(14)19-15(23)10-2-5-12(6-3-10)22(24)25/h2-9H,1H3,(H,19,23)