7-oxidanylidene-6-(1-oxidanylpropyl)-3-(1-prop-2-enylpyrrolidin-3-yl)sulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 7-oxidanylidene-6-(1-oxidanylpropyl)-3-(1-prop-2-enylpyrrolidin-3-yl)sulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 3-(1-allylpyrrolidin-3-yl)sulfanyl-6-(1-hydroxypropyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-(1-hydroxypropyl)-7-oxo-3-[(1-prop-2-enyl-3-pyrrolidinyl)thio]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 6-(1-hydroxypropyl)-7-oxo-3-(1-prop-2-enylpyrrolidin-3-yl)sulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-[(1-allylpyrrolidin-3-yl)thio]-6-(1-hydroxypropyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C16H21N2O4S2- MolecularWeight: 369.47894

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1C2N(C1=O)C(=C(S2)SC3CCN(C3)CC=C)C(=O)[O-])O

Isomeric SMILES

CCC(C1C2N(C1=O)C(=C(S2)SC3CCN(C3)CC=C)C(=O)[O-])O

InChI

InChI=1S/C16H22N2O4S2/c1-3-6-17-7-5-9(8-17)23-16-12(15(21)22)18-13(20)11(10(19)4-2)14(18)24-16/h3,9-11,14,19H,1,4-8H2,2H3,(H,21,22)/p-1