ethyl 4-[(4-cyclopropylcarbonyl-3-methyl-piperazin-1-yl)methyl]-3-ethyl-2-oxidanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(4-cyclopropylcarbonyl-3-methyl-piperazin-1-yl)methyl]-3-ethyl-2-oxidanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-[[4-(cyclopropanecarbonyl)-3-methyl-piperazin-1-yl]methyl]-3-ethyl-2-oxo-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[[4-[cyclopropyl(oxo)methyl]-3-methyl-1-piperazinyl]methyl]-3-ethyl-2-oxo-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(cyclopropanecarbonyl)-3-methylpiperazin-1-yl]methyl]-3-ethyl-2-oxo-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-[[4-(cyclopropanecarbonyl)-3-methyl-piperazino]methyl]-3-ethyl-2-keto-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H32N4O4S MolecularWeight: 460.58958

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CSC=C2)C(=O)OCC)CN3CCN(C(C3)C)C(=O)C4CC4

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CSC=C2)C(=O)OCC)CN3CCN(C(C3)C)C(=O)C4CC4

InChI

InChI=1S/C23H32N4O4S/c1-4-26-18(13-25-9-10-27(15(3)12-25)21(28)16-6-7-16)19(22(29)31-5-2)20(24-23(26)30)17-8-11-32-14-17/h8,11,14-16,20H,4-7,9-10,12-13H2,1-3H3,(H,24,30)