2-methyl-4-[(2-methyl-2,3-dihydro-1-benzofuran-7-yl)carbonylamino]-5-propyl-pyrazole-3-carboxamide

Systemtic Name: 2-methyl-4-[(2-methyl-2,3-dihydro-1-benzofuran-7-yl)carbonylamino]-5-propyl-pyrazole-3-carboxamide Openeye Name: 2-methyl-4-[(2-methyl-2,3-dihydrobenzofuran-7-carbonyl)amino]-5-propyl-pyrazole-3-carboxamide CAS Name: 2-methyl-4-[[(2-methyl-2,3-dihydrobenzofuran-7-yl)-oxomethyl]amino]-5-propyl-3-pyrazolecarboxamide IUPAC Name: 2-methyl-4-[(2-methyl-2,3-dihydro-1-benzofuran-7-carbonyl)amino]-5-propylpyrazole-3-carboxamide Traditional Name: 2-methyl-4-[(2-methylcoumaran-7-carbonyl)amino]-5-propyl-pyrazole-3-carboxamide Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1NC(=O)C2=C3C(=CC=C2)CC(O3)C)C(=O)N)C

Isomeric SMILES

CCCC1=NN(C(=C1NC(=O)C2=C3C(=CC=C2)CC(O3)C)C(=O)N)C

InChI

InChI=1S/C18H22N4O3/c1-4-6-13-14(15(17(19)23)22(3)21-13)20-18(24)12-8-5-7-11-9-10(2)25-16(11)12/h5,7-8,10H,4,6,9H2,1-3H3,(H2,19,23)(H,20,24)