ethyl (E)-2-cyano-3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]prop-2-enoate CAS Name: (E)-2-cyano-3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]acrylic acid ethyl ester Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NC2=C(S1)C=C(C=C2)OC)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=NC2=C(S1)C=C(C=C2)OC)/C#N

InChI

InChI=1S/C14H13N3O3S/c1-3-20-13(18)9(7-15)8-16-14-17-11-5-4-10(19-2)6-12(11)21-14/h4-6,8H,3H2,1-2H3,(H,16,17)/b9-8+