methyl 2-[[5-(1H-inden-1-yl)-4-oxidanylidene-3-(3-propylsulfanylcarbonylphenyl)furan-2-yl]amino]butanoate

Systemtic Name: methyl 2-[[5-(1H-inden-1-yl)-4-oxidanylidene-3-(3-propylsulfanylcarbonylphenyl)furan-2-yl]amino]butanoate Openeye Name: methyl 2-[[5-(1H-inden-1-yl)-4-oxo-3-(3-propylsulfanylcarbonylphenyl)-2-furyl]amino]butanoate CAS Name: 2-[[5-(1H-inden-1-yl)-4-oxo-3-[3-[oxo-(propylthio)methyl]phenyl]-2-furanyl]amino]butanoic acid methyl ester IUPAC Name: methyl 2-[[5-(1H-inden-1-yl)-4-oxo-3-(3-propylsulfanylcarbonylphenyl)furan-2-yl]amino]butanoate Traditional Name: 2-[[5-(1H-inden-1-yl)-4-keto-3-[3-(propylthio)carbonylphenyl]-2-furyl]amino]butyric acid methyl ester Formula: C28H29NO5S MolecularWeight: 491.59856

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(=O)C1=CC=CC(=C1)C2=C(OC(C2=O)C3C=CC4=CC=CC=C34)NC(CC)C(=O)OC

Isomeric SMILES

CCCSC(=O)C1=CC=CC(=C1)C2=C(OC(C2=O)C3C=CC4=CC=CC=C34)NC(CC)C(=O)OC

InChI

InChI=1S/C28H29NO5S/c1-4-15-35-28(32)19-11-8-10-18(16-19)23-24(30)25(21-14-13-17-9-6-7-12-20(17)21)34-26(23)29-22(5-2)27(31)33-3/h6-14,16,21-22,25,29H,4-5,15H2,1-3H3