4-oxidanylidene-N-phenethyl-4-(5-phenyl-3,4-dihydropyrazol-2-yl)-N-(thiophen-2-ylmethyl)butanamide

Systemtic Name: 4-oxidanylidene-N-phenethyl-4-(5-phenyl-3,4-dihydropyrazol-2-yl)-N-(thiophen-2-ylmethyl)butanamide Openeye Name: 4-oxo-N-phenethyl-4-(5-phenyl-3,4-dihydropyrazol-2-yl)-N-(2-thienylmethyl)butanamide CAS Name: 4-oxo-N-phenethyl-4-(5-phenyl-3,4-dihydropyrazol-2-yl)-N-(thiophen-2-ylmethyl)butanamide IUPAC Name: 4-oxo-N-phenethyl-4-(5-phenyl-3,4-dihydropyrazol-2-yl)-N-(thiophen-2-ylmethyl)butanamide Traditional Name: 4-keto-N-phenethyl-4-(3-phenyl-2-pyrazolin-1-yl)-N-(2-thenyl)butyramide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)N(CCC3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)N(CCC3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C26H27N3O2S/c30-25(13-14-26(31)29-18-16-24(27-29)22-10-5-2-6-11-22)28(20-23-12-7-19-32-23)17-15-21-8-3-1-4-9-21/h1-12,19H,13-18,20H2