methyl 4-[[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoate CAS Name: 4-[[[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]carbamoyl]benzoate Traditional Name: 4-[[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoic acid methyl ester Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)C4=CC=C(C=C4)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)C4=CC=C(C=C4)C(=O)OC)C

InChI

InChI=1S/C22H20N4O3S/c1-12-9-13(2)19-17(10-12)30-22(24-19)26-18(11-14(3)25-26)23-20(27)15-5-7-16(8-6-15)21(28)29-4/h5-11H,1-4H3,(H,23,27)