4-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonyl-2-propyl-phthalazin-1-one

Systemtic Name: 4-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonyl-2-propyl-phthalazin-1-one Openeye Name: 4-[4-[(5-methyl-2-thienyl)sulfonyl]piperazine-1-carbonyl]-2-propyl-phthalazin-1-one CAS Name: 4-[[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]-oxomethyl]-2-propyl-1-phthalazinone IUPAC Name: 4-[4-(5-methylthiophen-2-yl)sulfonylpiperazine-1-carbonyl]-2-propylphthalazin-1-one Traditional Name: 4-[4-[(5-methyl-2-thienyl)sulfonyl]piperazine-1-carbonyl]-2-propyl-phthalazin-1-one Formula: C21H24N4O4S2 MolecularWeight: 460.56966

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)C

InChI

InChI=1S/C21H24N4O4S2/c1-3-10-25-20(26)17-7-5-4-6-16(17)19(22-25)21(27)23-11-13-24(14-12-23)31(28,29)18-9-8-15(2)30-18/h4-9H,3,10-14H2,1-2H3