2-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 2-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]pyrimidine CAS Name: 2-[4-(3,4-diethoxyphenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 2-[4-(3,4-diethoxyphenyl)sulfonylpiperazino]pyrimidine Formula: C18H24N4O4S MolecularWeight: 392.47256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3)OCC

InChI

InChI=1S/C18H24N4O4S/c1-3-25-16-7-6-15(14-17(16)26-4-2)27(23,24)22-12-10-21(11-13-22)18-19-8-5-9-20-18/h5-9,14H,3-4,10-13H2,1-2H3