(E)-2-(1,3-benzothiazol-2-yl)-3-(6-methoxyquinolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(6-methoxyquinolin-2-yl)prop-2-enenitrile Openeye Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(6-methoxy-2-quinolyl)prop-2-enenitrile CAS Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(6-methoxy-2-quinolinyl)-2-propenenitrile IUPAC Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(6-methoxyquinolin-2-yl)prop-2-enenitrile Traditional Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(6-methoxy-2-quinolyl)acrylonitrile Formula: C20H13N3OS MolecularWeight: 343.40172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C=C2)C=C(C#N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C=C2)/C=C(\C#N)/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H13N3OS/c1-24-16-8-9-17-13(11-16)6-7-15(22-17)10-14(12-21)20-23-18-4-2-3-5-19(18)25-20/h2-11H,1H3/b14-10+