N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[(2S)-2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]-1-methyl-6-oxo-pyridazine-3-carboxamide CAS Name: N-[(2S)-2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]-1-methyl-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1-methyl-6-oxopyridazine-3-carboxamide Traditional Name: 6-keto-N-[(2S)-2-(4-methoxyphenyl)-2-piperidino-ethyl]-1-methyl-pyridazine-3-carboxamide Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)C(=O)NCC(C2=CC=C(C=C2)OC)N3CCCCC3

Isomeric SMILES

CN1C(=O)C=CC(=N1)C(=O)NC[C@H](C2=CC=C(C=C2)OC)N3CCCCC3

InChI

InChI=1S/C20H26N4O3/c1-23-19(25)11-10-17(22-23)20(26)21-14-18(24-12-4-3-5-13-24)15-6-8-16(27-2)9-7-15/h6-11,18H,3-5,12-14H2,1-2H3,(H,21,26)/t18-/m1/s1