N-[1-[4-[4-(4-cyclopropylcarbonylphenyl)but-3-ynyl]piperazin-1-yl]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[1-[4-[4-(4-cyclopropylcarbonylphenyl)but-3-ynyl]piperazin-1-yl]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide Openeye Name: N-[2-[4-[4-[4-(cyclopropanecarbonyl)phenyl]but-3-ynyl]piperazin-1-yl]-1-methyl-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[1-[4-[4-[4-[cyclopropyl(oxo)methyl]phenyl]but-3-ynyl]-1-piperazinyl]-1-oxopropan-2-yl]-2-furancarboxamide IUPAC Name: N-[1-[4-[4-[4-(cyclopropanecarbonyl)phenyl]but-3-ynyl]piperazin-1-yl]-1-oxopropan-2-yl]furan-2-carboxamide Traditional Name: N-[2-[4-[4-[4-(cyclopropanecarbonyl)phenyl]but-3-ynyl]piperazino]-2-keto-1-methyl-ethyl]-2-furamide Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CCC#CC2=CC=C(C=C2)C(=O)C3CC3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CCC#CC2=CC=C(C=C2)C(=O)C3CC3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C26H29N3O4/c1-19(27-25(31)23-6-4-18-33-23)26(32)29-16-14-28(15-17-29)13-3-2-5-20-7-9-21(10-8-20)24(30)22-11-12-22/h4,6-10,18-19,22H,3,11-17H2,1H3,(H,27,31)