4-(2,5-dimethylthiophen-3-yl)-N-methyl-4-oxidanylidene-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]butanamide

Systemtic Name: 4-(2,5-dimethylthiophen-3-yl)-N-methyl-4-oxidanylidene-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]butanamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-(2,5-dimethyl-3-thienyl)-N-methyl-4-oxo-butanamide CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-N-methyl-4-oxo-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]butanamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-(2,5-dimethylthiophen-3-yl)-N-methyl-4-oxobutanamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-(2,5-dimethyl-3-thienyl)-4-keto-N-methyl-butyramide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)N(C)CC2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)N(C)CC2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2S/c1-16-11-20(17(2)28-16)21(26)9-10-22(27)24(3)13-19-12-23-25(15-19)14-18-7-5-4-6-8-18/h4-8,11-12,15H,9-10,13-14H2,1-3H3