ethyl 5-[2-[2-(2-acetamidoethylamino)pyridin-4-yl]-1,3-thiazol-4-yl]-2-methyl-6-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-[2-[2-(2-acetamidoethylamino)pyridin-4-yl]-1,3-thiazol-4-yl]-2-methyl-6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-[2-[2-(2-acetamidoethylamino)-4-pyridyl]thiazol-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxylate CAS Name: 5-[2-[2-(2-acetamidoethylamino)-4-pyridinyl]-4-thiazolyl]-2-methyl-6-oxo-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[2-(2-acetamidoethylamino)pyridin-4-yl]-1,3-thiazol-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxylate Traditional Name: 5-[2-[2-(2-acetamidoethylamino)-4-pyridyl]thiazol-4-yl]-6-keto-2-methyl-1H-pyridine-3-carboxylic acid ethyl ester Formula: C21H23N5O4S MolecularWeight: 441.50342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)C(=C1)C2=CSC(=N2)C3=CC(=NC=C3)NCCNC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)C(=C1)C2=CSC(=N2)C3=CC(=NC=C3)NCCNC(=O)C)C

InChI

InChI=1S/C21H23N5O4S/c1-4-30-21(29)15-10-16(19(28)25-12(15)2)17-11-31-20(26-17)14-5-6-23-18(9-14)24-8-7-22-13(3)27/h5-6,9-11H,4,7-8H2,1-3H3,(H,22,27)(H,23,24)(H,25,28)