2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanamide

Systemtic Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanamide Openeye Name: 2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide CAS Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[4-(2-oxo-1-pyrrolidinyl)phenyl]propanamide IUPAC Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide Traditional Name: 2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-[4-(2-ketopyrrolidino)phenyl]propionamide Formula: C22H23N5O2S2 MolecularWeight: 453.58032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCCC2=O)SC3=NN=C(N3C4CC4)C5=CC=CS5

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCCC2=O)SC3=NN=C(N3C4CC4)C5=CC=CS5

InChI

InChI=1S/C22H23N5O2S2/c1-14(21(29)23-15-6-8-16(9-7-15)26-12-2-5-19(26)28)31-22-25-24-20(18-4-3-13-30-18)27(22)17-10-11-17/h3-4,6-9,13-14,17H,2,5,10-12H2,1H3,(H,23,29)