N-[(4-chlorophenyl)methyl]-1-[(4-dimethylaminophenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-[(4-dimethylaminophenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-[(4-dimethylaminophenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-[(4-dimethylaminophenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxo-2-piperazinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-[(4-dimethylaminophenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-(4-chlorobenzyl)-1-[4-(dimethylamino)benzyl]-6-keto-4-mesyl-2-methyl-piperazine-2-carboxamide Formula: C23H29ClN4O4S MolecularWeight: 493.01876

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC(=O)N1CC2=CC=C(C=C2)N(C)C)S(=O)(=O)C)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1(CN(CC(=O)N1CC2=CC=C(C=C2)N(C)C)S(=O)(=O)C)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H29ClN4O4S/c1-23(22(30)25-13-17-5-9-19(24)10-6-17)16-27(33(4,31)32)15-21(29)28(23)14-18-7-11-20(12-8-18)26(2)3/h5-12H,13-16H2,1-4H3,(H,25,30)