1-(2-cyclopent-2-en-1-ylethyl)-6-(3,5-dimethylphenyl)sulfanyl-5-propan-2-yl-pyrimidine-2,4-dione

Systemtic Name: 1-(2-cyclopent-2-en-1-ylethyl)-6-(3,5-dimethylphenyl)sulfanyl-5-propan-2-yl-pyrimidine-2,4-dione Openeye Name: 1-(2-cyclopent-2-en-1-ylethyl)-6-(3,5-dimethylphenyl)sulfanyl-5-isopropyl-pyrimidine-2,4-dione CAS Name: 1-[2-(1-cyclopent-2-enyl)ethyl]-6-[(3,5-dimethylphenyl)thio]-5-propan-2-ylpyrimidine-2,4-dione IUPAC Name: 1-(2-cyclopent-2-en-1-ylethyl)-6-(3,5-dimethylphenyl)sulfanyl-5-propan-2-ylpyrimidine-2,4-dione Traditional Name: 1-(2-cyclopent-2-en-1-ylethyl)-6-[(3,5-dimethylphenyl)thio]-5-isopropyl-pyrimidine-2,4-quinone Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC2=C(C(=O)NC(=O)N2CCC3CCC=C3)C(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)SC2=C(C(=O)NC(=O)N2CCC3CCC=C3)C(C)C)C

InChI

InChI=1S/C22H28N2O2S/c1-14(2)19-20(25)23-22(26)24(10-9-17-7-5-6-8-17)21(19)27-18-12-15(3)11-16(4)13-18/h5,7,11-14,17H,6,8-10H2,1-4H3,(H,23,25,26)