4-[4-[4-(2-methoxyethoxy)phenyl]sulfonylpiperazin-1-yl]-6-methyl-2-propan-2-yl-pyrimidine

Systemtic Name: 4-[4-[4-(2-methoxyethoxy)phenyl]sulfonylpiperazin-1-yl]-6-methyl-2-propan-2-yl-pyrimidine Openeye Name: 2-isopropyl-4-[4-[4-(2-methoxyethoxy)phenyl]sulfonylpiperazin-1-yl]-6-methyl-pyrimidine CAS Name: 4-[4-[4-(2-methoxyethoxy)phenyl]sulfonyl-1-piperazinyl]-6-methyl-2-propan-2-ylpyrimidine IUPAC Name: 4-[4-[4-(2-methoxyethoxy)phenyl]sulfonylpiperazin-1-yl]-6-methyl-2-propan-2-ylpyrimidine Traditional Name: 2-isopropyl-4-[4-[4-(2-methoxyethoxy)phenyl]sulfonylpiperazino]-6-methyl-pyrimidine Formula: C21H30N4O4S MolecularWeight: 434.5523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OCCOC

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OCCOC

InChI

InChI=1S/C21H30N4O4S/c1-16(2)21-22-17(3)15-20(23-21)24-9-11-25(12-10-24)30(26,27)19-7-5-18(6-8-19)29-14-13-28-4/h5-8,15-16H,9-14H2,1-4H3