tert-butyl 2-(4-chlorophenyl)sulfanyl-4-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-3-oxidanylidene-piperazine-1-carboxylate

Systemtic Name: tert-butyl 2-(4-chlorophenyl)sulfanyl-4-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-3-oxidanylidene-piperazine-1-carboxylate Openeye Name: tert-butyl 2-(4-chlorophenyl)sulfanyl-4-(2-methoxy-2-oxo-ethyl)-2-methyl-3-oxo-piperazine-1-carboxylate CAS Name: 2-[(4-chlorophenyl)thio]-4-(2-methoxy-2-oxoethyl)-2-methyl-3-oxo-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-chlorophenyl)sulfanyl-4-(2-methoxy-2-oxoethyl)-2-methyl-3-oxopiperazine-1-carboxylate Traditional Name: 2-[(4-chlorophenyl)thio]-3-keto-4-(2-keto-2-methoxy-ethyl)-2-methyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C19H25ClN2O5S MolecularWeight: 428.9302

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(CCN1C(=O)OC(C)(C)C)CC(=O)OC)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1(C(=O)N(CCN1C(=O)OC(C)(C)C)CC(=O)OC)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H25ClN2O5S/c1-18(2,3)27-17(25)22-11-10-21(12-15(23)26-5)16(24)19(22,4)28-14-8-6-13(20)7-9-14/h6-9H,10-12H2,1-5H3