ethyl 2-[(1-naphthalen-2-ylsulfonylpiperidin-4-yl)amino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[(1-naphthalen-2-ylsulfonylpiperidin-4-yl)amino]pyrimidine-5-carboxylate Openeye Name: ethyl 2-[[1-(2-naphthylsulfonyl)-4-piperidyl]amino]pyrimidine-5-carboxylate CAS Name: 2-[[1-(2-naphthalenylsulfonyl)-4-piperidinyl]amino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1-naphthalen-2-ylsulfonylpiperidin-4-yl)amino]pyrimidine-5-carboxylate Traditional Name: 2-[[1-(2-naphthylsulfonyl)-4-piperidyl]amino]pyrimidine-5-carboxylic acid ethyl ester Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1)NC2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1)NC2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H24N4O4S/c1-2-30-21(27)18-14-23-22(24-15-18)25-19-9-11-26(12-10-19)31(28,29)20-8-7-16-5-3-4-6-17(16)13-20/h3-8,13-15,19H,2,9-12H2,1H3,(H,23,24,25)