methyl 4-[[[(2R)-2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]carbamothioylamino]butanoate

Systemtic Name: methyl 4-[[[(2R)-2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]carbamothioylamino]butanoate Openeye Name: methyl 4-[[[(2R)-2-(4-methyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]carbamothioylamino]butanoate CAS Name: 4-[[[[(2R)-2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]hydrazo]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[[(2R)-2-(4-methyl-2-oxochromen-7-yl)oxypropanoyl]amino]carbamothioylamino]butanoate Traditional Name: 4-[[[(2R)-2-(2-keto-4-methyl-chromen-7-yl)oxypropanoyl]amino]thiocarbamoylamino]butyric acid methyl ester Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NNC(=S)NCCCC(=O)OC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)O[C@H](C)C(=O)NNC(=S)NCCCC(=O)OC

InChI

InChI=1S/C19H23N3O6S/c1-11-9-17(24)28-15-10-13(6-7-14(11)15)27-12(2)18(25)21-22-19(29)20-8-4-5-16(23)26-3/h6-7,9-10,12H,4-5,8H2,1-3H3,(H,21,25)(H2,20,22,29)/t12-/m1/s1