5-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]sulfonyl-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 5-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]sulfonyl-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 5-[[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidyl]sulfonyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 5-[[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidinyl]sulfonyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 5-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]sulfonyl-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-5-[4-(2-p-phenetylethyl)piperidino]sulfonyl-pyrimidine-2,4-quinone Formula: C21H29N3O5S MolecularWeight: 435.53706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCC2CCN(CC2)S(=O)(=O)C3=CN(C(=O)N(C3=O)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CCC2CCN(CC2)S(=O)(=O)C3=CN(C(=O)N(C3=O)C)C

InChI

InChI=1S/C21H29N3O5S/c1-4-29-18-9-7-16(8-10-18)5-6-17-11-13-24(14-12-17)30(27,28)19-15-22(2)21(26)23(3)20(19)25/h7-10,15,17H,4-6,11-14H2,1-3H3