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

Systemtic Name: methyl 4-[[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoate CAS Name: 4-[[[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]carbamoyl]benzoate Traditional Name: 4-[[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoic acid methyl ester Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)C(=O)OC)C3=NC4=C(S3)C=C(C=C4)OC

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)C(=O)OC)C3=NC4=C(S3)C=C(C=C4)OC

InChI

InChI=1S/C21H18N4O4S/c1-12-10-18(23-19(26)13-4-6-14(7-5-13)20(27)29-3)25(24-12)21-22-16-9-8-15(28-2)11-17(16)30-21/h4-11H,1-3H3,(H,23,26)