N-[(2S)-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-[4-(2,5-dimethylphenyl)piperazino]-2-keto-ethyl]-2-furamide Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)[C@H](CC3=CC=CC=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C26H29N3O3/c1-19-10-11-20(2)23(17-19)28-12-14-29(15-13-28)26(31)22(18-21-7-4-3-5-8-21)27-25(30)24-9-6-16-32-24/h3-11,16-17,22H,12-15,18H2,1-2H3,(H,27,30)/t22-/m0/s1