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

Systemtic Name: methyl 6-(4-chloranyl-3-nitro-phenyl)-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate Openeye Name: methyl 6-(4-chloro-3-nitro-phenyl)-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate CAS Name: 6-(4-chloro-3-nitrophenyl)-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylic acid methyl ester IUPAC Name: methyl 6-(4-chloro-3-nitrophenyl)-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate Traditional Name: 6-(4-chloro-3-nitro-phenyl)-8-methyl-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylic acid methyl ester Formula: C16H16ClN3O4S MolecularWeight: 381.83394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2CCCSC2=N1)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(N2CCCSC2=N1)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H16ClN3O4S/c1-9-13(15(21)24-2)14(19-6-3-7-25-16(19)18-9)10-4-5-11(17)12(8-10)20(22)23/h4-5,8,14H,3,6-7H2,1-2H3