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

Systemtic Name: 4-(5-chloranylthiophen-2-yl)-N-methyl-4-oxidanylidene-N-[(1-phenylpyrazol-4-yl)methyl]butanamide Openeye Name: 4-(5-chloro-2-thienyl)-N-methyl-4-oxo-N-[(1-phenylpyrazol-4-yl)methyl]butanamide CAS Name: 4-(5-chloro-2-thiophenyl)-N-methyl-4-oxo-N-[(1-phenyl-4-pyrazolyl)methyl]butanamide IUPAC Name: 4-(5-chlorothiophen-2-yl)-N-methyl-4-oxo-N-[(1-phenylpyrazol-4-yl)methyl]butanamide Traditional Name: 4-(5-chloro-2-thienyl)-4-keto-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]butyramide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClN3O2S/c1-22(19(25)10-7-16(24)17-8-9-18(20)26-17)12-14-11-21-23(13-14)15-5-3-2-4-6-15/h2-6,8-9,11,13H,7,10,12H2,1H3