(4Z)-5-(4-methoxyphenyl)-2-(phenylmethyl)-4-(thiophen-2-ylmethylidene)pyrazol-3-one

Systemtic Name: (4Z)-5-(4-methoxyphenyl)-2-(phenylmethyl)-4-(thiophen-2-ylmethylidene)pyrazol-3-one Openeye Name: (4Z)-2-benzyl-5-(4-methoxyphenyl)-4-(2-thienylmethylene)pyrazol-3-one CAS Name: (4Z)-5-(4-methoxyphenyl)-2-(phenylmethyl)-4-(thiophen-2-ylmethylidene)-3-pyrazolone IUPAC Name: (4Z)-2-benzyl-5-(4-methoxyphenyl)-4-(thiophen-2-ylmethylidene)pyrazol-3-one Traditional Name: (4Z)-2-benzyl-5-(4-methoxyphenyl)-4-(2-thenylidene)-2-pyrazolin-3-one Formula: C22H18N2O2S MolecularWeight: 374.45552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C2=CC3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C\2=NN(C(=O)/C2=C\C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C22H18N2O2S/c1-26-18-11-9-17(10-12-18)21-20(14-19-8-5-13-27-19)22(25)24(23-21)15-16-6-3-2-4-7-16/h2-14H,15H2,1H3/b20-14-