ethyl 2-[(1-propan-2-ylpyrazol-3-yl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[(1-propan-2-ylpyrazol-3-yl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[(1-isopropylpyrazole-3-carbonyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[oxo-(1-propan-2-yl-3-pyrazolyl)methyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1-propan-2-ylpyrazole-3-carbonyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(1-isopropylpyrazole-3-carbonyl)amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C=C3)C(C)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C=C3)C(C)C

InChI

InChI=1S/C17H18N4O3S/c1-4-24-16(23)11-5-6-12-14(9-11)25-17(18-12)19-15(22)13-7-8-21(20-13)10(2)3/h5-10H,4H2,1-3H3,(H,18,19,22)