5,6-dimethyl-2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]-1,3-benzothiazole

Systemtic Name: 5,6-dimethyl-2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]-1,3-benzothiazole Openeye Name: 2-[(E)-2-(4-isopentyloxyphenyl)vinyl]-5,6-dimethyl-1,3-benzothiazole CAS Name: 5,6-dimethyl-2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]-1,3-benzothiazole IUPAC Name: 5,6-dimethyl-2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]-1,3-benzothiazole Traditional Name: 2-[(E)-2-(4-isoamoxyphenyl)vinyl]-5,6-dimethyl-1,3-benzothiazole Formula: C22H25NOS MolecularWeight: 351.505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)C=CC3=CC=C(C=C3)OCCC(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)/C=C/C3=CC=C(C=C3)OCCC(C)C

InChI

InChI=1S/C22H25NOS/c1-15(2)11-12-24-19-8-5-18(6-9-19)7-10-22-23-20-13-16(3)17(4)14-21(20)25-22/h5-10,13-15H,11-12H2,1-4H3/b10-7+