N-[4-[4-ethyl-5-(4-methanoyl-2-nitro-phenyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]ethanamide

Systemtic Name: N-[4-[4-ethyl-5-(4-methanoyl-2-nitro-phenyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]ethanamide Openeye Name: N-[4-[4-ethyl-5-(4-formyl-2-nitro-phenyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]acetamide CAS Name: N-[4-[4-ethyl-5-[(4-formyl-2-nitrophenyl)thio]-1,2,4-triazol-3-yl]phenyl]acetamide IUPAC Name: N-[4-[4-ethyl-5-(4-formyl-2-nitrophenyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]acetamide Traditional Name: N-[4-[4-ethyl-5-[(4-formyl-2-nitro-phenyl)thio]-1,2,4-triazol-3-yl]phenyl]acetamide Formula: C19H17N5O4S MolecularWeight: 411.43438

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=C(C=C(C=C2)C=O)[N+](=O)[O-])C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCN1C(=NN=C1SC2=C(C=C(C=C2)C=O)[N+](=O)[O-])C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C19H17N5O4S/c1-3-23-18(14-5-7-15(8-6-14)20-12(2)26)21-22-19(23)29-17-9-4-13(11-25)10-16(17)24(27)28/h4-11H,3H2,1-2H3,(H,20,26)