(2R)-N-cycloheptyl-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: (2R)-N-cycloheptyl-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: (2R)-3-benzylsulfanyl-N-cycloheptyl-2-(1-oxoisoindolin-2-yl)propanamide CAS Name: (2R)-N-cycloheptyl-2-(3-oxo-1H-isoindol-2-yl)-3-(phenylmethylthio)propanamide IUPAC Name: (2R)-3-benzylsulfanyl-N-cycloheptyl-2-(3-oxo-1H-isoindol-2-yl)propanamide Traditional Name: (2R)-3-(benzylthio)-N-cycloheptyl-2-(1-ketoisoindolin-2-yl)propionamide Formula: C25H30N2O2S MolecularWeight: 422.5829

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C(CSCC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

C1CCCC(CC1)NC(=O)[C@H](CSCC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H30N2O2S/c28-24(26-21-13-6-1-2-7-14-21)23(18-30-17-19-10-4-3-5-11-19)27-16-20-12-8-9-15-22(20)25(27)29/h3-5,8-12,15,21,23H,1-2,6-7,13-14,16-18H2,(H,26,28)/t23-/m0/s1