5-[6-[5-(hydroxymethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]pentanenitrile

Systemtic Name: 5-[6-[5-(hydroxymethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]pentanenitrile Openeye Name: 5-[6-[5-(hydroxymethyl)-2-oxo-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]pentanenitrile CAS Name: 5-[6-[5-(hydroxymethyl)-2-oxo-3-oxazolidinyl]-1,3-benzothiazol-2-yl]pentanenitrile IUPAC Name: 5-[6-[5-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]pentanenitrile Traditional Name: 5-[6-(2-keto-5-methylol-oxazolidin-3-yl)-1,3-benzothiazol-2-yl]valeronitrile Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)N1C2=CC3=C(C=C2)N=C(S3)CCCCC#N)CO

Isomeric SMILES

C1C(OC(=O)N1C2=CC3=C(C=C2)N=C(S3)CCCCC#N)CO

InChI

InChI=1S/C16H17N3O3S/c17-7-3-1-2-4-15-18-13-6-5-11(8-14(13)23-15)19-9-12(10-20)22-16(19)21/h5-6,8,12,20H,1-4,9-10H2