N-[1-azanyl-3-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]-1-(furan-2-ylcarbonyl)-4-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidine-2-carboxamide

Systemtic Name: N-[1-azanyl-3-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]-1-(furan-2-ylcarbonyl)-4-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidine-2-carboxamide Openeye Name: N-[2-amino-1-[(4-methoxyphenyl)methyl]-2-oxo-ethyl]-1-(furan-2-carbonyl)-4-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidine-2-carboxamide CAS Name: N-[1-amino-3-(4-methoxyphenyl)-1-oxopropan-2-yl]-1-[2-furanyl(oxo)methyl]-4-[[[3-(methylthio)anilino]-oxomethyl]amino]-2-pyrrolidinecarboxamide IUPAC Name: N-[1-amino-3-(4-methoxyphenyl)-1-oxopropan-2-yl]-1-(furan-2-carbonyl)-4-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidine-2-carboxamide Traditional Name: N-(2-amino-2-keto-1-p-anisyl-ethyl)-1-(2-furoyl)-4-[[3-(methylthio)phenyl]carbamoylamino]pyrrolidine-2-carboxamide Formula: C28H31N5O6S MolecularWeight: 565.64064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)N)NC(=O)C2CC(CN2C(=O)C3=CC=CO3)NC(=O)NC4=CC(=CC=C4)SC

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)N)NC(=O)C2CC(CN2C(=O)C3=CC=CO3)NC(=O)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C28H31N5O6S/c1-38-20-10-8-17(9-11-20)13-22(25(29)34)32-26(35)23-15-19(16-33(23)27(36)24-7-4-12-39-24)31-28(37)30-18-5-3-6-21(14-18)40-2/h3-12,14,19,22-23H,13,15-16H2,1-2H3,(H2,29,34)(H,32,35)(H2,30,31,37)