2-(1,3-benzothiazol-2-yl)-5-(5-methylfuran-2-yl)-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-(5-methylfuran-2-yl)-3-oxidanylidene-pentanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-(5-methyl-2-furyl)-3-oxo-pentanenitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-5-(5-methyl-2-furanyl)-3-oxopentanenitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-(5-methylfuran-2-yl)-3-oxopentanenitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-3-keto-5-(5-methyl-2-furyl)valeronitrile Formula: C17H14N2O2S MolecularWeight: 310.37026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CCC(=O)C(C#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(O1)CCC(=O)C(C#N)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H14N2O2S/c1-11-6-7-12(21-11)8-9-15(20)13(10-18)17-19-14-4-2-3-5-16(14)22-17/h2-7,13H,8-9H2,1H3