3-methyl-1-[2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)carbonyl]pyrazolidin-1-yl]but-2-en-1-one

Systemtic Name: 3-methyl-1-[2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)carbonyl]pyrazolidin-1-yl]but-2-en-1-one Openeye Name: 3-methyl-1-[2-[2-(3-pyridyl)thiazole-4-carbonyl]pyrazolidin-1-yl]but-2-en-1-one CAS Name: 3-methyl-1-[2-[oxo-[2-(3-pyridinyl)-4-thiazolyl]methyl]-1-pyrazolidinyl]-2-buten-1-one IUPAC Name: 3-methyl-1-[2-(2-pyridin-3-yl-1,3-thiazole-4-carbonyl)pyrazolidin-1-yl]but-2-en-1-one Traditional Name: 3-methyl-1-[2-[2-(3-pyridyl)thiazole-4-carbonyl]pyrazolidin-1-yl]but-2-en-1-one Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCCN1C(=O)C2=CSC(=N2)C3=CN=CC=C3)C

Isomeric SMILES

CC(=CC(=O)N1CCCN1C(=O)C2=CSC(=N2)C3=CN=CC=C3)C

InChI

InChI=1S/C17H18N4O2S/c1-12(2)9-15(22)20-7-4-8-21(20)17(23)14-11-24-16(19-14)13-5-3-6-18-10-13/h3,5-6,9-11H,4,7-8H2,1-2H3