3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[(6-pyrrolidino-3-pyridyl)methyl]propionamide Formula: C15H22N4O2S MolecularWeight: 322.42578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C=C2)CNC(=O)CCSCC(=O)N

Isomeric SMILES

C1CCN(C1)C2=NC=C(C=C2)CNC(=O)CCSCC(=O)N

InChI

InChI=1S/C15H22N4O2S/c16-13(20)11-22-8-5-15(21)18-10-12-3-4-14(17-9-12)19-6-1-2-7-19/h3-4,9H,1-2,5-8,10-11H2,(H2,16,20)(H,18,21)