(3R)-N-[(1S)-2-(cyclohexylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-(furan-2-ylmethyl)-5-oxidanylidene-thiolane-3-carboxamide

Systemtic Name: (3R)-N-[(1S)-2-(cyclohexylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-(furan-2-ylmethyl)-5-oxidanylidene-thiolane-3-carboxamide Openeye Name: (3R)-N-[(1S)-2-(cyclohexylamino)-2-oxo-1-(4-pyridyl)ethyl]-N-(2-furylmethyl)-5-oxo-tetrahydrothiophene-3-carboxamide CAS Name: (3R)-N-[(1S)-2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(2-furanylmethyl)-5-oxo-3-thiolanecarboxamide IUPAC Name: (3R)-N-[(1S)-2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(furan-2-ylmethyl)-5-oxothiolane-3-carboxamide Traditional Name: (3R)-N-[(1S)-2-(cyclohexylamino)-2-keto-1-(4-pyridyl)ethyl]-N-(2-furfuryl)-5-keto-tetrahydrothiophene-3-carboxamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=NC=C2)N(CC3=CC=CO3)C(=O)C4CC(=O)SC4

Isomeric SMILES

C1CCC(CC1)NC(=O)[C@H](C2=CC=NC=C2)N(CC3=CC=CO3)C(=O)[C@H]4CC(=O)SC4

InChI

InChI=1S/C23H27N3O4S/c27-20-13-17(15-31-20)23(29)26(14-19-7-4-12-30-19)21(16-8-10-24-11-9-16)22(28)25-18-5-2-1-3-6-18/h4,7-12,17-18,21H,1-3,5-6,13-15H2,(H,25,28)/t17-,21-/m0/s1