3-azanyl-N-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl]-5-ethylsulfanyl-2-oxidanyl-pentanamide

Systemtic Name: 3-azanyl-N-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl]-5-ethylsulfanyl-2-oxidanyl-pentanamide Openeye Name: 3-amino-N-[4-(1,3-dioxoisoindolin-2-yl)butyl]-5-ethylsulfanyl-2-hydroxy-pentanamide CAS Name: 3-amino-N-[4-(1,3-dioxo-2-isoindolyl)butyl]-5-(ethylthio)-2-hydroxypentanamide IUPAC Name: 3-amino-N-[4-(1,3-dioxoisoindol-2-yl)butyl]-5-ethylsulfanyl-2-hydroxypentanamide Traditional Name: 3-amino-5-(ethylthio)-2-hydroxy-N-(4-phthalimidobutyl)valeramide Formula: C19H27N3O4S MolecularWeight: 393.50038

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCC(C(C(=O)NCCCCN1C(=O)C2=CC=CC=C2C1=O)O)N

Isomeric SMILES

CCSCCC(C(C(=O)NCCCCN1C(=O)C2=CC=CC=C2C1=O)O)N

InChI

InChI=1S/C19H27N3O4S/c1-2-27-12-9-15(20)16(23)17(24)21-10-5-6-11-22-18(25)13-7-3-4-8-14(13)19(22)26/h3-4,7-8,15-16,23H,2,5-6,9-12,20H2,1H3,(H,21,24)