3-(3-methoxy-4-propan-2-yloxy-phenyl)-N-[(E)-(phenylmethylidene)amino]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(3-methoxy-4-propan-2-yloxy-phenyl)-N-[(E)-(phenylmethylidene)amino]-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-benzylideneamino]-3-(4-isopropoxy-3-methoxy-phenyl)-1H-pyrazole-5-carboxamide CAS Name: 3-(3-methoxy-4-propan-2-yloxyphenyl)-N-[(E)-(phenylmethylene)amino]-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-benzylideneamino]-3-(3-methoxy-4-propan-2-yloxyphenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[(E)-benzalamino]-3-(4-isopropoxy-3-methoxy-phenyl)-1H-pyrazole-5-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)NN=CC3=CC=CC=C3)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC=CC=C3)OC

InChI

InChI=1S/C21H22N4O3/c1-14(2)28-19-10-9-16(11-20(19)27-3)17-12-18(24-23-17)21(26)25-22-13-15-7-5-4-6-8-15/h4-14H,1-3H3,(H,23,24)(H,25,26)/b22-13+