4-[4-(5-bromanyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-6-methyl-2-propan-2-yl-pyrimidine

Systemtic Name: 4-[4-(5-bromanyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-6-methyl-2-propan-2-yl-pyrimidine Openeye Name: 4-[4-(5-bromo-2-methyl-phenyl)sulfonylpiperazin-1-yl]-2-isopropyl-6-methyl-pyrimidine CAS Name: 4-[4-(5-bromo-2-methylphenyl)sulfonyl-1-piperazinyl]-6-methyl-2-propan-2-ylpyrimidine IUPAC Name: 4-[4-(5-bromo-2-methylphenyl)sulfonylpiperazin-1-yl]-6-methyl-2-propan-2-ylpyrimidine Traditional Name: 4-[4-(5-bromo-2-methyl-phenyl)sulfonylpiperazino]-2-isopropyl-6-methyl-pyrimidine Formula: C19H25BrN4O2S MolecularWeight: 453.3964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3)C)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3)C)C(C)C

InChI

InChI=1S/C19H25BrN4O2S/c1-13(2)19-21-15(4)11-18(22-19)23-7-9-24(10-8-23)27(25,26)17-12-16(20)6-5-14(17)3/h5-6,11-13H,7-10H2,1-4H3