ethyl 4-[4-oxidanylidene-3-[(E)-(4-oxidanylidene-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrido[1,2-a]pyrimidin-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-oxidanylidene-3-[(E)-(4-oxidanylidene-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrido[1,2-a]pyrimidin-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[4-oxo-3-[(E)-(4-oxo-3-propyl-2-thioxo-thiazolidin-5-ylidene)methyl]pyrido[1,2-a]pyrimidin-2-yl]piperazine-1-carboxylate CAS Name: 4-[4-oxo-3-[(E)-(4-oxo-3-propyl-2-sulfanylidene-5-thiazolidinylidene)methyl]-2-pyrido[1,2-a]pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-oxo-3-[(E)-(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrido[1,2-a]pyrimidin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[4-keto-3-[(E)-(4-keto-3-propyl-2-thioxo-thiazolidin-5-ylidene)methyl]pyrido[1,2-a]pyrimidin-2-yl]piperazine-1-carboxylic acid ethyl ester Formula: C22H25N5O4S2 MolecularWeight: 487.595

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C(=O)OCC)SC1=S

Isomeric SMILES

CCCN1C(=O)/C(=C\C2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C(=O)OCC)/SC1=S

InChI

InChI=1S/C22H25N5O4S2/c1-3-8-27-20(29)16(33-22(27)32)14-15-18(23-17-7-5-6-9-26(17)19(15)28)24-10-12-25(13-11-24)21(30)31-4-2/h5-7,9,14H,3-4,8,10-13H2,1-2H3/b16-14+