N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide Openeye Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide CAS Name: N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]-3-(3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide Traditional Name: N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propionamide Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)CCN3C=CC(=N3)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)CCN3C=CC(=N3)C)OCC

InChI

InChI=1S/C21H27N5O3/c1-4-28-19-7-6-17(12-20(19)29-5-2)14-26-15-18(13-22-26)23-21(27)9-11-25-10-8-16(3)24-25/h6-8,10,12-13,15H,4-5,9,11,14H2,1-3H3,(H,23,27)