[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: [4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [4-[6-(2-thienyl)pyridazin-3-yl]piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: [4-(6-thiophen-2-yl-3-pyridazinyl)-1-piperazinyl]-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: [4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Traditional Name: [4-[6-(2-thienyl)pyridazin-3-yl]piperazino]-(3,4,5-trimethoxyphenyl)methanone Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CS4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CS4

InChI

InChI=1S/C22H24N4O4S/c1-28-17-13-15(14-18(29-2)21(17)30-3)22(27)26-10-8-25(9-11-26)20-7-6-16(23-24-20)19-5-4-12-31-19/h4-7,12-14H,8-11H2,1-3H3