6-azanyl-3-methyl-5-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanoyl]-1-(2-methylpropyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-methyl-5-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanoyl]-1-(2-methylpropyl)pyrimidine-2,4-dione Openeye Name: 6-amino-1-isobutyl-3-methyl-5-[2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-5-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-oxoethyl]-1-(2-methylpropyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-3-methyl-5-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]acetyl]-1-(2-methylpropyl)pyrimidine-2,4-dione Traditional Name: 6-amino-1-isobutyl-3-methyl-5-[2-(4-tosylpiperazino)acetyl]pyrimidine-2,4-quinone Formula: C22H31N5O5S MolecularWeight: 477.57704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)C3=C(N(C(=O)N(C3=O)C)CC(C)C)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)C3=C(N(C(=O)N(C3=O)C)CC(C)C)N

InChI

InChI=1S/C22H31N5O5S/c1-15(2)13-27-20(23)19(21(29)24(4)22(27)30)18(28)14-25-9-11-26(12-10-25)33(31,32)17-7-5-16(3)6-8-17/h5-8,15H,9-14,23H2,1-4H3