6-chloranyl-7-[2-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]-4-methyl-chromen-2-one

Systemtic Name: 6-chloranyl-7-[2-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]-4-methyl-chromen-2-one Openeye Name: 6-chloro-7-[2-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)-2-oxo-ethoxy]-4-methyl-chromen-2-one CAS Name: 6-chloro-7-[2-[2,5-dimethyl-1-(2-thiazolyl)-3-pyrrolyl]-2-oxoethoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-7-[2-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxoethoxy]-4-methylchromen-2-one Traditional Name: 6-chloro-7-[2-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)-2-keto-ethoxy]-4-methyl-coumarin Formula: C21H17ClN2O4S MolecularWeight: 428.88868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)C3=C(N(C(=C3)C)C4=NC=CS4)C

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)C3=C(N(C(=C3)C)C4=NC=CS4)C

InChI

InChI=1S/C21H17ClN2O4S/c1-11-6-20(26)28-18-9-19(16(22)8-14(11)18)27-10-17(25)15-7-12(2)24(13(15)3)21-23-4-5-29-21/h4-9H,10H2,1-3H3