ethyl 6-[3-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]phenyl]-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate

Systemtic Name: ethyl 6-[3-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]phenyl]-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate Openeye Name: ethyl 6-[3-[(3-chloro-2,2-dimethyl-propanoyl)amino]phenyl]-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate CAS Name: 6-[3-[(3-chloro-2,2-dimethyl-1-oxopropyl)amino]phenyl]-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-[(3-chloro-2,2-dimethylpropanoyl)amino]phenyl]-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate Traditional Name: 6-[3-[(3-chloro-2,2-dimethyl-propanoyl)amino]phenyl]-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylic acid ethyl ester Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2N(C1C3=CC(=CC=C3)NC(=O)C(C)(C)CCl)CCCS2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2N(C1C3=CC(=CC=C3)NC(=O)C(C)(C)CCl)CCCS2)C

InChI

InChI=1S/C22H28ClN3O3S/c1-5-29-19(27)17-14(2)24-21-26(10-7-11-30-21)18(17)15-8-6-9-16(12-15)25-20(28)22(3,4)13-23/h6,8-9,12,18H,5,7,10-11,13H2,1-4H3,(H,25,28)