1-[6-[5-(methoxymethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]piperidine-4-carbonitrile

Systemtic Name: 1-[6-[5-(methoxymethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]piperidine-4-carbonitrile Openeye Name: 1-[6-[5-(methoxymethyl)-2-oxo-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]piperidine-4-carbonitrile CAS Name: 1-[6-[5-(methoxymethyl)-2-oxo-3-oxazolidinyl]-1,3-benzothiazol-2-yl]-4-piperidinecarbonitrile IUPAC Name: 1-[6-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]piperidine-4-carbonitrile Traditional Name: 1-[6-[2-keto-5-(methoxymethyl)oxazolidin-3-yl]-1,3-benzothiazol-2-yl]isonipecotonitrile Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CN(C(=O)O1)C2=CC3=C(C=C2)N=C(S3)N4CCC(CC4)C#N

Isomeric SMILES

COCC1CN(C(=O)O1)C2=CC3=C(C=C2)N=C(S3)N4CCC(CC4)C#N

InChI

InChI=1S/C18H20N4O3S/c1-24-11-14-10-22(18(23)25-14)13-2-3-15-16(8-13)26-17(20-15)21-6-4-12(9-19)5-7-21/h2-3,8,12,14H,4-7,10-11H2,1H3