2-[(E)-2-(2,4-dipropoxyphenyl)ethenyl]-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-(2,4-dipropoxyphenyl)ethenyl]-1,3-benzothiazole Openeye Name: 2-[(E)-2-(2,4-dipropoxyphenyl)vinyl]-1,3-benzothiazole CAS Name: 2-[(E)-2-(2,4-dipropoxyphenyl)ethenyl]-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(2,4-dipropoxyphenyl)ethenyl]-1,3-benzothiazole Traditional Name: 2-[(E)-2-(2,4-dipropoxyphenyl)vinyl]-1,3-benzothiazole Formula: C21H23NO2S MolecularWeight: 353.47782

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C=CC2=NC3=CC=CC=C3S2)OCCC

Isomeric SMILES

CCCOC1=CC(=C(C=C1)/C=C/C2=NC3=CC=CC=C3S2)OCCC

InChI

InChI=1S/C21H23NO2S/c1-3-13-23-17-11-9-16(19(15-17)24-14-4-2)10-12-21-22-18-7-5-6-8-20(18)25-21/h5-12,15H,3-4,13-14H2,1-2H3/b12-10+