ethyl (E)-2-cyano-3-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-[2,5-dimethyl-1-(2-thiazolyl)-3-pyrrolyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)acrylic acid ethyl ester Formula: C15H15N3O2S MolecularWeight: 301.3635

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N(C(=C1)C)C2=NC=CS2)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(N(C(=C1)C)C2=NC=CS2)C)/C#N

InChI

InChI=1S/C15H15N3O2S/c1-4-20-14(19)13(9-16)8-12-7-10(2)18(11(12)3)15-17-5-6-21-15/h5-8H,4H2,1-3H3/b13-8+