6-azanylidene-5-[2-[(4-chlorophenyl)methylsulfonyl]-1-phenyl-ethyl]-1,3-dimethyl-1,3-diazinane-2,4-dione

Systemtic Name: 6-azanylidene-5-[2-[(4-chlorophenyl)methylsulfonyl]-1-phenyl-ethyl]-1,3-dimethyl-1,3-diazinane-2,4-dione Openeye Name: 5-[2-[(4-chlorophenyl)methylsulfonyl]-1-phenyl-ethyl]-6-imino-1,3-dimethyl-hexahydropyrimidine-2,4-dione CAS Name: 5-[2-[(4-chlorophenyl)methylsulfonyl]-1-phenylethyl]-6-imino-1,3-dimethyl-1,3-diazinane-2,4-dione IUPAC Name: 5-[2-[(4-chlorophenyl)methylsulfonyl]-1-phenylethyl]-6-imino-1,3-dimethyl-1,3-diazinane-2,4-dione Traditional Name: 5-[2-(4-chlorobenzyl)sulfonyl-1-phenyl-ethyl]-6-imino-1,3-dimethyl-5,6-dihydrouracil Formula: C21H22ClN3O4S MolecularWeight: 447.93508

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=N)C(C(=O)N(C1=O)C)C(CS(=O)(=O)CC2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CN1C(=N)C(C(=O)N(C1=O)C)C(CS(=O)(=O)CC2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3O4S/c1-24-19(23)18(20(26)25(2)21(24)27)17(15-6-4-3-5-7-15)13-30(28,29)12-14-8-10-16(22)11-9-14/h3-11,17-18,23H,12-13H2,1-2H3