methyl (2Z)-2-[5-azanyl-6-cyano-8-[(2,4-dimethylphenyl)carbamoyl]-7-(4-methoxyphenyl)-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridin-2-ylidene]ethanoate

Systemtic Name: methyl (2Z)-2-[5-azanyl-6-cyano-8-[(2,4-dimethylphenyl)carbamoyl]-7-(4-methoxyphenyl)-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridin-2-ylidene]ethanoate Openeye Name: methyl (2Z)-2-[5-amino-6-cyano-8-[(2,4-dimethylphenyl)carbamoyl]-7-(4-methoxyphenyl)-3-oxo-7H-thiazolo[3,2-a]pyridin-2-ylidene]acetate CAS Name: (2Z)-2-[5-amino-6-cyano-8-[(2,4-dimethylanilino)-oxomethyl]-7-(4-methoxyphenyl)-3-oxo-7H-thiazolo[3,2-a]pyridin-2-ylidene]acetic acid methyl ester IUPAC Name: methyl (2Z)-2-[5-amino-6-cyano-8-[(2,4-dimethylphenyl)carbamoyl]-7-(4-methoxyphenyl)-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridin-2-ylidene]acetate Traditional Name: (2Z)-2-[5-amino-6-cyano-8-[(2,4-dimethylphenyl)carbamoyl]-3-keto-7-(4-methoxyphenyl)-7H-thiazolo[3,2-a]pyridin-2-ylidene]acetic acid methyl ester Formula: C27H24N4O5S MolecularWeight: 516.56826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C3N(C(=C(C2C4=CC=C(C=C4)OC)C#N)N)C(=O)C(=CC(=O)OC)S3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C3N(C(=C(C2C4=CC=C(C=C4)OC)C#N)N)C(=O)/C(=C/C(=O)OC)/S3)C

InChI

InChI=1S/C27H24N4O5S/c1-14-5-10-19(15(2)11-14)30-25(33)23-22(16-6-8-17(35-3)9-7-16)18(13-28)24(29)31-26(34)20(37-27(23)31)12-21(32)36-4/h5-12,22H,29H2,1-4H3,(H,30,33)/b20-12-