3-(4-pentoxyphenyl)-N-[(E)-thiophen-2-ylmethylideneamino]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-pentoxyphenyl)-N-[(E)-thiophen-2-ylmethylideneamino]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-pentoxyphenyl)-N-[(E)-2-thienylmethyleneamino]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-pentoxyphenyl)-N-[(E)-thiophen-2-ylmethylideneamino]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-pentoxyphenyl)-N-[(E)-thiophen-2-ylmethylideneamino]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-amoxyphenyl)-N-[(E)-2-thenylideneamino]-1H-pyrazole-5-carboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NN=CC3=CC=CS3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC=CS3

InChI

InChI=1S/C20H22N4O2S/c1-2-3-4-11-26-16-9-7-15(8-10-16)18-13-19(23-22-18)20(25)24-21-14-17-6-5-12-27-17/h5-10,12-14H,2-4,11H2,1H3,(H,22,23)(H,24,25)/b21-14+