ethyl (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-(2-chloranylpyrimidin-4-yl)ethanoate

Systemtic Name: ethyl (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-(2-chloranylpyrimidin-4-yl)ethanoate Openeye Name: ethyl (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-(2-chloropyrimidin-4-yl)acetate CAS Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-(2-chloro-4-pyrimidinyl)acetic acid ethyl ester IUPAC Name: ethyl (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-(2-chloropyrimidin-4-yl)acetate Traditional Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-(2-chloropyrimidin-4-yl)acetic acid ethyl ester Formula: C15H12ClN3O2S MolecularWeight: 333.79268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1NC2=CC=CC=C2S1)C3=NC(=NC=C3)Cl

Isomeric SMILES

CCOC(=O)/C(=C\1/NC2=CC=CC=C2S1)/C3=NC(=NC=C3)Cl

InChI

InChI=1S/C15H12ClN3O2S/c1-2-21-14(20)12(10-7-8-17-15(16)19-10)13-18-9-5-3-4-6-11(9)22-13/h3-8,18H,2H2,1H3/b13-12-