6-[4-[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate

Systemtic Name: 6-[4-[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate Openeye Name: 6-[4-[(2-methoxyphenyl)methyl-(2-thienylmethyl)carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate CAS Name: 6-[4-[[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]-oxomethyl]-5-methyl-1-pyrazolyl]-3-pyridazinolate IUPAC Name: 6-[4-[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)carbamoyl]-5-methylpyrazol-1-yl]pyridazin-3-olate Traditional Name: 6-[5-methyl-4-[o-anisyl(2-thenyl)carbamoyl]pyrazol-1-yl]pyridazin-3-olate Formula: C22H20N5O3S- MolecularWeight: 434.4909

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NN=C(C=C2)[O-])C(=O)N(CC3=CC=CC=C3OC)CC4=CC=CS4

Isomeric SMILES

CC1=C(C=NN1C2=NN=C(C=C2)[O-])C(=O)N(CC3=CC=CC=C3OC)CC4=CC=CS4

InChI

InChI=1S/C22H21N5O3S/c1-15-18(12-23-27(15)20-9-10-21(28)25-24-20)22(29)26(14-17-7-5-11-31-17)13-16-6-3-4-8-19(16)30-2/h3-12H,13-14H2,1-2H3,(H,25,28)/p-1