N-[4-[2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]furan-2-carboxamide

Systemtic Name: N-[4-[2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]furan-2-carboxamide Openeye Name: N-[4-[2-[4-(azepane-1-carbonyl)-1-piperidyl]-2-oxo-ethyl]thiazol-2-yl]furan-2-carboxamide CAS Name: N-[4-[2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-2-oxoethyl]-2-thiazolyl]-2-furancarboxamide IUPAC Name: N-[4-[2-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide Traditional Name: N-[4-[2-[4-(azepane-1-carbonyl)piperidino]-2-keto-ethyl]thiazol-2-yl]-2-furamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)CC3=CSC(=N3)NC(=O)C4=CC=CO4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)CC3=CSC(=N3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H28N4O4S/c27-19(14-17-15-31-22(23-17)24-20(28)18-6-5-13-30-18)25-11-7-16(8-12-25)21(29)26-9-3-1-2-4-10-26/h5-6,13,15-16H,1-4,7-12,14H2,(H,23,24,28)