N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxidanylidene-4-thiophen-2-yl-butanamide

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxo-4-(2-thienyl)butanamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-keto-4-(2-thienyl)butyramide Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C19H19N3O2S/c1-13-19(14(2)22(21-13)15-7-4-3-5-8-15)20-18(24)11-10-16(23)17-9-6-12-25-17/h3-9,12H,10-11H2,1-2H3,(H,20,24)