N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[[(4-propylphenyl)-thiophen-2-yl-methyl]amino]propanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[[(4-propylphenyl)-thiophen-2-yl-methyl]amino]propanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[[(4-propylphenyl)-(2-thienyl)methyl]amino]propanamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[[(4-propylphenyl)-thiophen-2-ylmethyl]amino]propanamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[[(4-propylphenyl)-thiophen-2-ylmethyl]amino]propanamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-[[(4-propylphenyl)-(2-thienyl)methyl]amino]propionamide Formula: C28H32N4O2S MolecularWeight: 488.64428

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(C)C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(C)C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C28H32N4O2S/c1-5-10-21-14-16-22(17-15-21)26(24-13-9-18-35-24)29-19(2)27(33)30-25-20(3)31(4)32(28(25)34)23-11-7-6-8-12-23/h6-9,11-19,26,29H,5,10H2,1-4H3,(H,30,33)