N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide

Systemtic Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide Openeye Name: 1-benzyl-N-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]-6-oxo-pyridazine-3-carboxamide CAS Name: N-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-6-oxo-1-(phenylmethyl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-6-oxopyridazine-3-carboxamide Traditional Name: 1-benzyl-N-[4-(3,5-dimethylpiperidino)sulfonylphenyl]-6-keto-pyridazine-3-carboxamide Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H28N4O4S/c1-18-14-19(2)16-28(15-18)34(32,33)22-10-8-21(9-11-22)26-25(31)23-12-13-24(30)29(27-23)17-20-6-4-3-5-7-20/h3-13,18-19H,14-17H2,1-2H3,(H,26,31)