5-[(3S)-1,2-dithiolan-3-yl]-N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]pentanamide

Systemtic Name: 5-[(3S)-1,2-dithiolan-3-yl]-N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]pentanamide Openeye Name: 5-[(3S)-dithiolan-3-yl]-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]pentanamide CAS Name: 5-[(3S)-3-dithiolanyl]-N-[3-methoxy-4-(2-oxo-1-pyrrolidinyl)phenyl]pentanamide IUPAC Name: 5-[(3S)-dithiolan-3-yl]-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]pentanamide Traditional Name: 5-[(3S)-dithiolan-3-yl]-N-[4-(2-ketopyrrolidino)-3-methoxy-phenyl]valeramide Formula: C19H26N2O3S2 MolecularWeight: 394.55134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)CCCCC2CCSS2)N3CCCC3=O

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)CCCC[C@H]2CCSS2)N3CCCC3=O

InChI

InChI=1S/C19H26N2O3S2/c1-24-17-13-14(8-9-16(17)21-11-4-7-19(21)23)20-18(22)6-3-2-5-15-10-12-25-26-15/h8-9,13,15H,2-7,10-12H2,1H3,(H,20,22)/t15-/m0/s1