[3-(2-methyl-1,3-thiazol-4-yl)-4-oxidanylidene-chromen-7-yl] 2-azanyl-3-methyl-pentanoate

Systemtic Name: [3-(2-methyl-1,3-thiazol-4-yl)-4-oxidanylidene-chromen-7-yl] 2-azanyl-3-methyl-pentanoate Openeye Name: [3-(2-methylthiazol-4-yl)-4-oxo-chromen-7-yl] 2-amino-3-methyl-pentanoate CAS Name: 2-amino-3-methylpentanoic acid [3-(2-methyl-4-thiazolyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methyl-1,3-thiazol-4-yl)-4-oxochromen-7-yl] 2-amino-3-methylpentanoate Traditional Name: 2-amino-3-methyl-valeric acid [4-keto-3-(2-methylthiazol-4-yl)chromen-7-yl] ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CSC(=N3)C)N

Isomeric SMILES

CCC(C)C(C(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CSC(=N3)C)N

InChI

InChI=1S/C19H20N2O4S/c1-4-10(2)17(20)19(23)25-12-5-6-13-16(7-12)24-8-14(18(13)22)15-9-26-11(3)21-15/h5-10,17H,4,20H2,1-3H3