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

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-N-methyl-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N-methyl-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-keto-N-methyl-4-(2-thienyl)butyramide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O2S/c1-15-18(16(2)24(22-15)17-8-5-4-6-9-17)14-23(3)21(26)12-11-19(25)20-10-7-13-27-20/h4-10,13H,11-12,14H2,1-3H3