[2-(1-azanyl-3-methylsulfanyl-propyl)-6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-chromen-7-yl] 2-azanyl-4-methylsulfanyl-butanoate

Systemtic Name: [2-(1-azanyl-3-methylsulfanyl-propyl)-6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-chromen-7-yl] 2-azanyl-4-methylsulfanyl-butanoate Openeye Name: [2-(1-amino-3-methylsulfanyl-propyl)-6-ethyl-3-(4-methylthiazol-2-yl)-4-oxo-chromen-7-yl] 2-amino-4-methylsulfanyl-butanoate CAS Name: 2-amino-4-(methylthio)butanoic acid [2-[1-amino-3-(methylthio)propyl]-6-ethyl-3-(4-methyl-2-thiazolyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [2-(1-amino-3-methylsulfanylpropyl)-6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxochromen-7-yl] 2-amino-4-methylsulfanylbutanoate Traditional Name: 2-amino-4-(methylthio)butyric acid [2-[1-amino-3-(methylthio)propyl]-6-ethyl-4-keto-3-(4-methylthiazol-2-yl)chromen-7-yl] ester Formula: C24H31N3O4S3 MolecularWeight: 521.71564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(CCSC)N)C3=NC(=CS3)C)OC(=O)C(CCSC)N

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(CCSC)N)C3=NC(=CS3)C)OC(=O)C(CCSC)N

InChI

InChI=1S/C24H31N3O4S3/c1-5-14-10-15-19(11-18(14)31-24(29)17(26)7-9-33-4)30-22(16(25)6-8-32-3)20(21(15)28)23-27-13(2)12-34-23/h10-12,16-17H,5-9,25-26H2,1-4H3