methyl 5-[[4-[(1-propan-2-ylbenzotriazol-5-yl)carbonylamino]pyrazol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[(1-propan-2-ylbenzotriazol-5-yl)carbonylamino]pyrazol-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-[(1-isopropylbenzotriazole-5-carbonyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[4-[[oxo-(1-propan-2-yl-5-benzotriazolyl)methyl]amino]-1-pyrazolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(1-propan-2-ylbenzotriazole-5-carbonyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[(1-isopropylbenzotriazole-5-carbonyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C20H20N6O4 MolecularWeight: 408.4106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)C(=O)NC3=CN(N=C3)CC4=CC=C(O4)C(=O)OC)N=N1

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)C(=O)NC3=CN(N=C3)CC4=CC=C(O4)C(=O)OC)N=N1

InChI

InChI=1S/C20H20N6O4/c1-12(2)26-17-6-4-13(8-16(17)23-24-26)19(27)22-14-9-21-25(10-14)11-15-5-7-18(30-15)20(28)29-3/h4-10,12H,11H2,1-3H3,(H,22,27)