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

Systemtic Name: 4-(5-chloranylthiophen-2-yl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-4-oxidanylidene-butanamide Openeye Name: 4-(5-chloro-2-thienyl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-4-oxo-butanamide CAS Name: 4-(5-chloro-2-thiophenyl)-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-N-methyl-4-oxobutanamide IUPAC Name: 4-(5-chlorothiophen-2-yl)-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N-methyl-4-oxobutanamide Traditional Name: 4-(5-chloro-2-thienyl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-keto-N-methyl-butyramide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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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=C(S3)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)C(=O)CCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-14-17(15(2)25(23-14)16-7-5-4-6-8-16)13-24(3)21(27)12-9-18(26)19-10-11-20(22)28-19/h4-8,10-11H,9,12-13H2,1-3H3