ethyl 2-[[5-[(5-tert-butyl-2-methyl-phenyl)sulfanylmethyl]furan-2-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: ethyl 2-[[5-[(5-tert-butyl-2-methyl-phenyl)sulfanylmethyl]furan-2-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: ethyl 2-[[5-[(5-tert-butyl-2-methyl-phenyl)sulfanylmethyl]furan-2-carbonyl]amino]-2-phenyl-acetate CAS Name: 2-[[[5-[[(5-tert-butyl-2-methylphenyl)thio]methyl]-2-furanyl]-oxomethyl]amino]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl 2-[[5-[(5-tert-butyl-2-methylphenyl)sulfanylmethyl]furan-2-carbonyl]amino]-2-phenylacetate Traditional Name: 2-[[5-[[(5-tert-butyl-2-methyl-phenyl)thio]methyl]-2-furoyl]amino]-2-phenyl-acetic acid ethyl ester Formula: C27H31NO4S MolecularWeight: 465.60434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)NC(=O)C2=CC=C(O2)CSC3=C(C=CC(=C3)C(C)(C)C)C

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)NC(=O)C2=CC=C(O2)CSC3=C(C=CC(=C3)C(C)(C)C)C

InChI

InChI=1S/C27H31NO4S/c1-6-31-26(30)24(19-10-8-7-9-11-19)28-25(29)22-15-14-21(32-22)17-33-23-16-20(27(3,4)5)13-12-18(23)2/h7-16,24H,6,17H2,1-5H3,(H,28,29)