N-(5-ethyl-1-methyl-1,2,4-triazol-3-yl)-5-[1-(2-methylsulfanylethanoyl)pyrrolidin-2-yl]thiophene-2-carboxamide

Systemtic Name: N-(5-ethyl-1-methyl-1,2,4-triazol-3-yl)-5-[1-(2-methylsulfanylethanoyl)pyrrolidin-2-yl]thiophene-2-carboxamide Openeye Name: N-(5-ethyl-1-methyl-1,2,4-triazol-3-yl)-5-[1-(2-methylsulfanylacetyl)pyrrolidin-2-yl]thiophene-2-carboxamide CAS Name: N-(5-ethyl-1-methyl-1,2,4-triazol-3-yl)-5-[1-[2-(methylthio)-1-oxoethyl]-2-pyrrolidinyl]-2-thiophenecarboxamide IUPAC Name: N-(5-ethyl-1-methyl-1,2,4-triazol-3-yl)-5-[1-(2-methylsulfanylacetyl)pyrrolidin-2-yl]thiophene-2-carboxamide Traditional Name: N-(5-ethyl-1-methyl-1,2,4-triazol-3-yl)-5-[1-[2-(methylthio)acetyl]pyrrolidin-2-yl]thiophene-2-carboxamide Formula: C17H23N5O2S2 MolecularWeight: 393.52682

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1C)NC(=O)C2=CC=C(S2)C3CCCN3C(=O)CSC

Isomeric SMILES

CCC1=NC(=NN1C)NC(=O)C2=CC=C(S2)C3CCCN3C(=O)CSC

InChI

InChI=1S/C17H23N5O2S2/c1-4-14-18-17(20-21(14)2)19-16(24)13-8-7-12(26-13)11-6-5-9-22(11)15(23)10-25-3/h7-8,11H,4-6,9-10H2,1-3H3,(H,19,20,24)