4-azanyl-N-[(3-methoxyphenyl)methyl]-5-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-1,2-thiazole-3-carboxamide

Systemtic Name: 4-azanyl-N-[(3-methoxyphenyl)methyl]-5-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-1,2-thiazole-3-carboxamide Openeye Name: 4-amino-N-[(3-methoxyphenyl)methyl]-5-[4-(2-pyridyl)piperazine-1-carbonyl]isothiazole-3-carboxamide CAS Name: 4-amino-N-[(3-methoxyphenyl)methyl]-5-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-3-isothiazolecarboxamide IUPAC Name: 4-amino-N-[(3-methoxyphenyl)methyl]-5-(4-pyridin-2-ylpiperazine-1-carbonyl)-1,2-thiazole-3-carboxamide Traditional Name: 4-amino-N-m-anisyl-5-[4-(2-pyridyl)piperazine-1-carbonyl]isothiazole-3-carboxamide Formula: C22H24N6O3S MolecularWeight: 452.52936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2=NSC(=C2N)C(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2=NSC(=C2N)C(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C22H24N6O3S/c1-31-16-6-4-5-15(13-16)14-25-21(29)19-18(23)20(32-26-19)22(30)28-11-9-27(10-12-28)17-7-2-3-8-24-17/h2-8,13H,9-12,14,23H2,1H3,(H,25,29)