N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C)C

InChI

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