2-methyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)carbonyl-phthalazin-1-one

Systemtic Name: 2-methyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)carbonyl-phthalazin-1-one Openeye Name: 2-methyl-4-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 2-methyl-4-[oxo-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methyl]-1-phthalazinone IUPAC Name: 2-methyl-4-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]phthalazin-1-one Traditional Name: 2-methyl-4-[4-(2-thenoyl)piperazine-1-carbonyl]phthalazin-1-one Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C19H18N4O3S/c1-21-17(24)14-6-3-2-5-13(14)16(20-21)19(26)23-10-8-22(9-11-23)18(25)15-7-4-12-27-15/h2-7,12H,8-11H2,1H3