4-chloranyl-N-[2-[4-ethyl-5-(1-oxidanylidene-1-phenylazanyl-propan-2-yl)sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide

Systemtic Name: 4-chloranyl-N-[2-[4-ethyl-5-(1-oxidanylidene-1-phenylazanyl-propan-2-yl)sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: N-[2-[5-(2-anilino-1-methyl-2-oxo-ethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]-4-chloro-benzamide CAS Name: N-[2-[5-[(1-anilino-1-oxopropan-2-yl)thio]-4-ethyl-1,2,4-triazol-3-yl]ethyl]-4-chlorobenzamide IUPAC Name: N-[2-[5-(1-anilino-1-oxopropan-2-yl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]-4-chlorobenzamide Traditional Name: N-[2-[5-[(2-anilino-2-keto-1-methyl-ethyl)thio]-4-ethyl-1,2,4-triazol-3-yl]ethyl]-4-chloro-benzamide Formula: C22H24ClN5O2S MolecularWeight: 457.97626

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NC2=CC=CC=C2)CCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C(=NN=C1SC(C)C(=O)NC2=CC=CC=C2)CCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClN5O2S/c1-3-28-19(13-14-24-21(30)16-9-11-17(23)12-10-16)26-27-22(28)31-15(2)20(29)25-18-7-5-4-6-8-18/h4-12,15H,3,13-14H2,1-2H3,(H,24,30)(H,25,29)