N-(4-methoxyphenyl)-5-[[2-oxidanylidene-2-(3-pyrrolidin-1-ylpropylamino)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-5-[[2-oxidanylidene-2-(3-pyrrolidin-1-ylpropylamino)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-methoxyphenyl)-5-[[2-oxo-2-(3-pyrrolidin-1-ylpropylamino)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-methoxyphenyl)-5-[[[2-oxo-2-[3-(1-pyrrolidinyl)propylamino]ethyl]thio]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-methoxyphenyl)-5-[[2-oxo-2-(3-pyrrolidin-1-ylpropylamino)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[[2-keto-2-(3-pyrrolidinopropylamino)ethyl]thio]methyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide Formula: C20H27N5O3S2 MolecularWeight: 449.59008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)NCCCN3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)NCCCN3CCCC3

InChI

InChI=1S/C20H27N5O3S2/c1-28-16-7-5-15(6-8-16)22-19(27)20-24-23-18(30-20)14-29-13-17(26)21-9-4-12-25-10-2-3-11-25/h5-8H,2-4,9-14H2,1H3,(H,21,26)(H,22,27)