2-methyl-5-[4-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)piperazin-1-yl]pyridazin-3-one

Systemtic Name: 2-methyl-5-[4-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)piperazin-1-yl]pyridazin-3-one Openeye Name: 2-methyl-5-[4-(4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)piperazin-1-yl]pyridazin-3-one CAS Name: 2-methyl-5-[4-[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]-1-piperazinyl]-3-pyridazinone IUPAC Name: 2-methyl-5-[4-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)piperazin-1-yl]pyridazin-3-one Traditional Name: 2-methyl-5-[4-(4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)piperazino]pyridazin-3-one Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(C=N1)N2CCN(CC2)C(=O)C3=CSC4=C3CCCC4

Isomeric SMILES

CN1C(=O)C=C(C=N1)N2CCN(CC2)C(=O)C3=CSC4=C3CCCC4

InChI

InChI=1S/C18H22N4O2S/c1-20-17(23)10-13(11-19-20)21-6-8-22(9-7-21)18(24)15-12-25-16-5-3-2-4-14(15)16/h10-12H,2-9H2,1H3