7-oxidanylidene-6-(3-pyrrolidin-1-ylprop-1-en-2-yl)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 7-oxidanylidene-6-(3-pyrrolidin-1-ylprop-1-en-2-yl)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 7-oxo-6-[1-(pyrrolidin-1-ylmethyl)vinyl]-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 7-oxo-6-[3-(1-pyrrolidinyl)prop-1-en-2-yl]-6-(3-pyrrolidinylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 7-oxo-6-(3-pyrrolidin-1-ylprop-1-en-2-yl)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 7-keto-6-[1-(pyrrolidinomethyl)vinyl]-6-(pyrrolidin-3-ylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN1CCCC1)C2(C3CC=C(N3C2=O)C(=O)O)SC4CCNC4

Isomeric SMILES

C=C(CN1CCCC1)C2(C3CC=C(N3C2=O)C(=O)O)SC4CCNC4

InChI

InChI=1S/C18H25N3O3S/c1-12(11-20-8-2-3-9-20)18(25-13-6-7-19-10-13)15-5-4-14(16(22)23)21(15)17(18)24/h4,13,15,19H,1-3,5-11H2,(H,22,23)