N-[2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-4-hydroxyimino-pentanamide

Systemtic Name: N-[2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-4-hydroxyimino-pentanamide Openeye Name: N-[2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-4-hydroxyimino-pentanamide CAS Name: N-[2-[2-(1,3-dioxan-2-yl)ethylthio]-1,3-benzothiazol-6-yl]-4-hydroxyiminopentanamide IUPAC Name: N-[2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-4-hydroxyiminopentanamide Traditional Name: N-[2-[2-(1,3-dioxan-2-yl)ethylthio]-1,3-benzothiazol-6-yl]-4-hydroximino-valeramide Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NO)CCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCCC3OCCCO3

Isomeric SMILES

CC(=NO)CCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCCC3OCCCO3

InChI

InChI=1S/C18H23N3O4S2/c1-12(21-23)3-6-16(22)19-13-4-5-14-15(11-13)27-18(20-14)26-10-7-17-24-8-2-9-25-17/h4-5,11,17,23H,2-3,6-10H2,1H3,(H,19,22)