N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[3-chloro-4-(2-ketopyrrolidino)phenyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C20H18ClN5O2S MolecularWeight: 427.90722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4)Cl

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4)Cl

InChI

InChI=1S/C20H18ClN5O2S/c21-16-10-15(7-8-17(16)26-9-1-2-18(26)27)24-19(28)14-5-3-13(4-6-14)11-29-20-22-12-23-25-20/h3-8,10,12H,1-2,9,11H2,(H,24,28)(H,22,23,25)