4-oxidanylidene-N-(3-piperidin-1-ylsulfonylphenyl)-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-(3-piperidin-1-ylsulfonylphenyl)-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-[3-(1-piperidylsulfonyl)phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-N-[3-(1-piperidinylsulfonyl)phenyl]-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-N-(3-piperidin-1-ylsulfonylphenyl)-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-(3-piperidinosulfonylphenyl)phthalazine-1-carboxamide Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H26N4O4S/c1-16(2)27-23(29)20-12-5-4-11-19(20)21(25-27)22(28)24-17-9-8-10-18(15-17)32(30,31)26-13-6-3-7-14-26/h4-5,8-12,15-16H,3,6-7,13-14H2,1-2H3,(H,24,28)