propan-2-yl 8-methyl-6-[4-(propanoylamino)phenyl]-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate

Systemtic Name: propan-2-yl 8-methyl-6-[4-(propanoylamino)phenyl]-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate Openeye Name: isopropyl 8-methyl-6-[4-(propanoylamino)phenyl]-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate CAS Name: 8-methyl-6-[4-(1-oxopropylamino)phenyl]-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 8-methyl-6-[4-(propanoylamino)phenyl]-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate Traditional Name: 8-methyl-6-(4-propionamidophenyl)-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylic acid isopropyl ester Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2C(=C(N=C3N2CCCS3)C)C(=O)OC(C)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2C(=C(N=C3N2CCCS3)C)C(=O)OC(C)C

InChI

InChI=1S/C21H27N3O3S/c1-5-17(25)23-16-9-7-15(8-10-16)19-18(20(26)27-13(2)3)14(4)22-21-24(19)11-6-12-28-21/h7-10,13,19H,5-6,11-12H2,1-4H3,(H,23,25)