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

Systemtic Name: 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]butanamide Openeye Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-4-(5-chloro-2-thienyl)-4-oxo-butanamide CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxo-N-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]butanamide IUPAC Name: N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-4-(5-chlorothiophen-2-yl)-4-oxobutanamide Traditional Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-4-(5-chloro-2-thienyl)-4-keto-butyramide Formula: C25H22ClN3O2S MolecularWeight: 463.97908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)CNC(=O)CCC(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)CNC(=O)CCC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C25H22ClN3O2S/c26-23-13-12-22(32-23)21(30)11-14-24(31)27-15-20-17-29(16-18-7-3-1-4-8-18)28-25(20)19-9-5-2-6-10-19/h1-10,12-13,17H,11,14-16H2,(H,27,31)