cyclohexyl 2-(8-methyl-2-oxidanyl-4-oxidanylidene-2,3-dihydropyrimido[2,1-b][1,3]benzothiazol-3-yl)hexanoate

Systemtic Name: cyclohexyl 2-(8-methyl-2-oxidanyl-4-oxidanylidene-2,3-dihydropyrimido[2,1-b][1,3]benzothiazol-3-yl)hexanoate Openeye Name: cyclohexyl 2-(2-hydroxy-8-methyl-4-oxo-2,3-dihydropyrimido[2,1-b][1,3]benzothiazol-3-yl)hexanoate CAS Name: 2-(2-hydroxy-8-methyl-4-oxo-2,3-dihydropyrimido[2,1-b][1,3]benzothiazol-3-yl)hexanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-(2-hydroxy-8-methyl-4-oxo-2,3-dihydropyrimido[2,1-b][1,3]benzothiazol-3-yl)hexanoate Traditional Name: 2-(2-hydroxy-4-keto-8-methyl-2,3-dihydropyrimido[2,1-b][1,3]benzothiazol-3-yl)hexanoic acid cyclohexyl ester Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1C(N=C2N(C1=O)C3=C(S2)C=C(C=C3)C)O)C(=O)OC4CCCCC4

Isomeric SMILES

CCCCC(C1C(N=C2N(C1=O)C3=C(S2)C=C(C=C3)C)O)C(=O)OC4CCCCC4

InChI

InChI=1S/C23H30N2O4S/c1-3-4-10-16(22(28)29-15-8-6-5-7-9-15)19-20(26)24-23-25(21(19)27)17-12-11-14(2)13-18(17)30-23/h11-13,15-16,19-20,26H,3-10H2,1-2H3