N-[[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]methyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzamide

Systemtic Name: N-[[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]methyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzamide Openeye Name: N-[(5-isobutylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-4-(2-oxopyrrolidin-1-yl)benzamide CAS Name: N-[[4-methyl-5-(2-methylpropylthio)-1,2,4-triazol-3-yl]methyl]-4-(2-oxo-1-pyrrolidinyl)benzamide IUPAC Name: N-[[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]methyl]-4-(2-oxopyrrolidin-1-yl)benzamide Traditional Name: N-[[5-(isobutylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]-4-(2-ketopyrrolidino)benzamide Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(N1C)CNC(=O)C2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CC(C)CSC1=NN=C(N1C)CNC(=O)C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C19H25N5O2S/c1-13(2)12-27-19-22-21-16(23(19)3)11-20-18(26)14-6-8-15(9-7-14)24-10-4-5-17(24)25/h6-9,13H,4-5,10-12H2,1-3H3,(H,20,26)