2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)ethenyl]-5-methoxy-6-methylsulfanyl-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)ethenyl]-5-methoxy-6-methylsulfanyl-1,3-benzothiazole Openeye Name: 2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)vinyl]-5-methoxy-6-methylsulfanyl-1,3-benzothiazole CAS Name: 2-[(E)-2-(4-ethoxy-3-methoxyphenyl)ethenyl]-5-methoxy-6-(methylthio)-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(4-ethoxy-3-methoxyphenyl)ethenyl]-5-methoxy-6-methylsulfanyl-1,3-benzothiazole Traditional Name: 2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)vinyl]-5-methoxy-6-(methylthio)-1,3-benzothiazole Formula: C20H21NO3S2 MolecularWeight: 387.51564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC2=NC3=CC(=C(C=C3S2)SC)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/C2=NC3=CC(=C(C=C3S2)SC)OC)OC

InChI

InChI=1S/C20H21NO3S2/c1-5-24-15-8-6-13(10-16(15)22-2)7-9-20-21-14-11-17(23-3)19(25-4)12-18(14)26-20/h6-12H,5H2,1-4H3/b9-7+