methyl 5-tert-butyl-3-[[4-[2-(1-oxidanylidenethiolan-3-yl)ethoxy]naphthalen-1-yl]carbamoylamino]furan-2-carboxylate

Systemtic Name: methyl 5-tert-butyl-3-[[4-[2-(1-oxidanylidenethiolan-3-yl)ethoxy]naphthalen-1-yl]carbamoylamino]furan-2-carboxylate Openeye Name: methyl 5-tert-butyl-3-[[4-[2-(1-oxothiolan-3-yl)ethoxy]-1-naphthyl]carbamoylamino]furan-2-carboxylate CAS Name: 5-tert-butyl-3-[[oxo-[[4-[2-(1-oxo-3-thiolanyl)ethoxy]-1-naphthalenyl]amino]methyl]amino]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-3-[[4-[2-(1-oxothiolan-3-yl)ethoxy]naphthalen-1-yl]carbamoylamino]furan-2-carboxylate Traditional Name: 5-tert-butyl-3-[[4-[2-(1-ketothiolan-3-yl)ethoxy]-1-naphthyl]carbamoylamino]furan-2-carboxylic acid methyl ester Formula: C27H32N2O6S MolecularWeight: 512.61778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(O1)C(=O)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OCCC4CCS(=O)C4

Isomeric SMILES

CC(C)(C)C1=CC(=C(O1)C(=O)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OCCC4CCS(=O)C4

InChI

InChI=1S/C27H32N2O6S/c1-27(2,3)23-15-21(24(35-23)25(30)33-4)29-26(31)28-20-9-10-22(19-8-6-5-7-18(19)20)34-13-11-17-12-14-36(32)16-17/h5-10,15,17H,11-14,16H2,1-4H3,(H2,28,29,31)