2-[(E)-2-(3-ethoxy-4-prop-2-ynoxy-phenyl)ethenyl]-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-(3-ethoxy-4-prop-2-ynoxy-phenyl)ethenyl]-1,3-benzothiazole Openeye Name: 2-[(E)-2-(3-ethoxy-4-prop-2-ynoxy-phenyl)vinyl]-1,3-benzothiazole CAS Name: 2-[(E)-2-(3-ethoxy-4-prop-2-ynoxyphenyl)ethenyl]-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(3-ethoxy-4-prop-2-ynoxyphenyl)ethenyl]-1,3-benzothiazole Traditional Name: 2-[(E)-2-(3-ethoxy-4-propargyloxy-phenyl)vinyl]-1,3-benzothiazole Formula: C20H17NO2S MolecularWeight: 335.41948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC2=NC3=CC=CC=C3S2)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C2=NC3=CC=CC=C3S2)OCC#C

InChI

InChI=1S/C20H17NO2S/c1-3-13-23-17-11-9-15(14-18(17)22-4-2)10-12-20-21-16-7-5-6-8-19(16)24-20/h1,5-12,14H,4,13H2,2H3/b12-10+