ethyl (E)-2-cyano-3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]prop-2-enoate CAS Name: (E)-2-cyano-3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]acrylic acid ethyl ester Formula: C15H15N3O2S MolecularWeight: 301.3635

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NC2=C(C=C(C=C2S1)C)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=NC2=C(C=C(C=C2S1)C)C)/C#N

InChI

InChI=1S/C15H15N3O2S/c1-4-20-14(19)11(7-16)8-17-15-18-13-10(3)5-9(2)6-12(13)21-15/h5-6,8H,4H2,1-3H3,(H,17,18)/b11-8+