methyl (2R)-2-[2-[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-chromen-7-yl]oxypropanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2R)-2-[2-[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-chromen-7-yl]oxypropanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2R)-2-[2-[6-ethyl-3-(4-methylthiazol-2-yl)-4-oxo-chromen-7-yl]oxypropanoylamino]-3-phenyl-propanoate CAS Name: (2R)-2-[[2-[[6-ethyl-3-(4-methyl-2-thiazolyl)-4-oxo-1-benzopyran-7-yl]oxy]-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[2-[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxochromen-7-yl]oxypropanoylamino]-3-phenylpropanoate Traditional Name: (2R)-2-[2-[6-ethyl-4-keto-3-(4-methylthiazol-2-yl)chromen-7-yl]oxypropanoylamino]-3-phenyl-propionic acid methyl ester Formula: C28H28N2O6S MolecularWeight: 520.59672

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)OC(C)C(=O)NC(CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)OC(C)C(=O)N[C@H](CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C28H28N2O6S/c1-5-19-12-20-24(35-14-21(25(20)31)27-29-16(2)15-37-27)13-23(19)36-17(3)26(32)30-22(28(33)34-4)11-18-9-7-6-8-10-18/h6-10,12-15,17,22H,5,11H2,1-4H3,(H,30,32)/t17?,22-/m1/s1