N-[3-[4-methyl-5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]benzamide

Systemtic Name: N-[3-[4-methyl-5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]benzamide Openeye Name: N-[3-[4-methyl-5-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]benzamide CAS Name: N-[3-[4-methyl-5-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-1,2,4-triazol-3-yl]phenyl]benzamide IUPAC Name: N-[3-[4-methyl-5-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]benzamide Traditional Name: N-[3-[5-[(2-keto-2-pyrrolidino-ethyl)thio]-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N2CCCC2)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N2CCCC2)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2S/c1-26-20(24-25-22(26)30-15-19(28)27-12-5-6-13-27)17-10-7-11-18(14-17)23-21(29)16-8-3-2-4-9-16/h2-4,7-11,14H,5-6,12-13,15H2,1H3,(H,23,29)