ethyl 6-[[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[4-methyl-3-(1-piperidylsulfonyl)anilino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[4-methyl-3-(1-piperidinylsulfonyl)anilino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-methyl-3-piperidin-1-ylsulfonylanilino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[(4-methyl-3-piperidinosulfonyl-anilino)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H28N4O5S MolecularWeight: 436.52512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CNC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CNC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H28N4O5S/c1-3-29-19(25)16-12-22-20(26)23-17(16)13-21-15-8-7-14(2)18(11-15)30(27,28)24-9-5-4-6-10-24/h7-8,11,21H,3-6,9-10,12-13H2,1-2H3,(H2,22,23,26)