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

Systemtic Name: 4-(5-chloranylthiophen-2-yl)-N-methyl-4-oxidanylidene-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]butanamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-(5-chloro-2-thienyl)-N-methyl-4-oxo-butanamide CAS Name: 4-(5-chloro-2-thiophenyl)-N-methyl-4-oxo-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]butanamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-(5-chlorothiophen-2-yl)-N-methyl-4-oxobutanamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-(5-chloro-2-thienyl)-4-keto-N-methyl-butyramide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)CCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)CCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C20H20ClN3O2S/c1-23(20(26)10-7-17(25)18-8-9-19(21)27-18)12-16-11-22-24(14-16)13-15-5-3-2-4-6-15/h2-6,8-9,11,14H,7,10,12-13H2,1H3