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

Systemtic Name: N-methyl-4-(5-methylthiophen-2-yl)-4-oxidanylidene-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]butanamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-4-(5-methyl-2-thienyl)-4-oxo-butanamide CAS Name: N-methyl-4-(5-methyl-2-thiophenyl)-4-oxo-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]butanamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-4-(5-methylthiophen-2-yl)-4-oxobutanamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-keto-N-methyl-4-(5-methyl-2-thienyl)butyramide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O2S/c1-16-8-10-20(27-16)19(25)9-11-21(26)23(2)13-18-12-22-24(15-18)14-17-6-4-3-5-7-17/h3-8,10,12,15H,9,11,13-14H2,1-2H3