5-(7-methoxy-1,3-benzothiazol-2-yl)-2-(2-methylpropoxy)benzenecarbonitrile

Systemtic Name: 5-(7-methoxy-1,3-benzothiazol-2-yl)-2-(2-methylpropoxy)benzenecarbonitrile Openeye Name: 2-isobutoxy-5-(7-methoxy-1,3-benzothiazol-2-yl)benzonitrile CAS Name: 5-(7-methoxy-1,3-benzothiazol-2-yl)-2-(2-methylpropoxy)benzonitrile IUPAC Name: 5-(7-methoxy-1,3-benzothiazol-2-yl)-2-(2-methylpropoxy)benzonitrile Traditional Name: 2-isobutoxy-5-(7-methoxy-1,3-benzothiazol-2-yl)benzonitrile Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C2=NC3=C(S2)C(=CC=C3)OC)C#N

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C2=NC3=C(S2)C(=CC=C3)OC)C#N

InChI

InChI=1S/C19H18N2O2S/c1-12(2)11-23-16-8-7-13(9-14(16)10-20)19-21-15-5-4-6-17(22-3)18(15)24-19/h4-9,12H,11H2,1-3H3