tert-butyl 4-[2-(4-methoxyphenyl)sulfanyl-5-methyl-phenyl]-3,5-bis(oxidanylidene)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(4-methoxyphenyl)sulfanyl-5-methyl-phenyl]-3,5-bis(oxidanylidene)piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-methoxyphenyl)sulfanyl-5-methyl-phenyl]-3,5-dioxo-piperazine-1-carboxylate CAS Name: 4-[2-[(4-methoxyphenyl)thio]-5-methylphenyl]-3,5-dioxo-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-methoxyphenyl)sulfanyl-5-methylphenyl]-3,5-dioxopiperazine-1-carboxylate Traditional Name: 3,5-diketo-4-[2-[(4-methoxyphenyl)thio]-5-methyl-phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=CC=C(C=C2)OC)N3C(=O)CN(CC3=O)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=CC=C(C=C2)OC)N3C(=O)CN(CC3=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H26N2O5S/c1-15-6-11-19(31-17-9-7-16(29-5)8-10-17)18(12-15)25-20(26)13-24(14-21(25)27)22(28)30-23(2,3)4/h6-12H,13-14H2,1-5H3