(4-cyanophenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: (4-cyanophenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: (4-cyanophenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid (4-cyanophenyl) ester Formula: C17H10N2O2S MolecularWeight: 306.3385

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C=CC(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C=C/C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H10N2O2S/c18-11-12-5-7-13(8-6-12)21-17(20)10-9-16-19-14-3-1-2-4-15(14)22-16/h1-10H/b10-9+