ethyl (2S)-2-azanyl-3-[3-[3-(2-diethylaminoethyl)-4-methyl-2-oxidanylidene-chromen-7-yl]oxy-2-oxidanyl-propyl]sulfanyl-propanoate

Systemtic Name: ethyl (2S)-2-azanyl-3-[3-[3-(2-diethylaminoethyl)-4-methyl-2-oxidanylidene-chromen-7-yl]oxy-2-oxidanyl-propyl]sulfanyl-propanoate Openeye Name: ethyl (2S)-2-amino-3-[3-[3-(2-diethylaminoethyl)-4-methyl-2-oxo-chromen-7-yl]oxy-2-hydroxy-propyl]sulfanyl-propanoate CAS Name: (2S)-2-amino-3-[[3-[[3-(2-diethylaminoethyl)-4-methyl-2-oxo-1-benzopyran-7-yl]oxy]-2-hydroxypropyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-amino-3-[3-[3-(2-diethylaminoethyl)-4-methyl-2-oxochromen-7-yl]oxy-2-hydroxypropyl]sulfanylpropanoate Traditional Name: (2S)-2-amino-3-[[3-[3-(2-diethylaminoethyl)-2-keto-4-methyl-chromen-7-yl]oxy-2-hydroxy-propyl]thio]propionic acid ethyl ester Formula: C24H36N2O6S MolecularWeight: 480.61744

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=C(C2=C(C=C(C=C2)OCC(CSCC(C(=O)OCC)N)O)OC1=O)C

Isomeric SMILES

CCN(CC)CCC1=C(C2=C(C=C(C=C2)OCC(CSC[C@H](C(=O)OCC)N)O)OC1=O)C

InChI

InChI=1S/C24H36N2O6S/c1-5-26(6-2)11-10-20-16(4)19-9-8-18(12-22(19)32-23(20)28)31-13-17(27)14-33-15-21(25)24(29)30-7-3/h8-9,12,17,21,27H,5-7,10-11,13-15,25H2,1-4H3/t17?,21-/m1/s1