N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-2-methoxy-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-methoxy-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-2-methoxy-5-pyrrolidinosulfonyl-benzamide Formula: C16H22N2O6S2 MolecularWeight: 402.48568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C16H22N2O6S2/c1-24-15-5-4-13(26(22,23)18-7-2-3-8-18)10-14(15)16(19)17-12-6-9-25(20,21)11-12/h4-5,10,12H,2-3,6-9,11H2,1H3,(H,17,19)/t12-/m0/s1