ethyl 2-[2-(1,4-dimethylpyrazol-3-yl)carbonylimino-6-propan-2-yl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-(1,4-dimethylpyrazol-3-yl)carbonylimino-6-propan-2-yl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(1,4-dimethylpyrazole-3-carbonyl)imino-6-isopropyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(1,4-dimethyl-3-pyrazolyl)-oxomethyl]imino-6-propan-2-yl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(1,4-dimethylpyrazole-3-carbonyl)imino-6-propan-2-yl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(1,4-dimethylpyrazole-3-carbonyl)imino-6-isopropyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)C3=NN(C=C3C)C

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)C3=NN(C=C3C)C

InChI

InChI=1S/C20H24N4O3S/c1-6-27-17(25)11-24-15-8-7-14(12(2)3)9-16(15)28-20(24)21-19(26)18-13(4)10-23(5)22-18/h7-10,12H,6,11H2,1-5H3