N-[2-[(3-bromophenyl)methylamino]-2-oxidanylidene-ethyl]-1,2-dimethyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide

Systemtic Name: N-[2-[(3-bromophenyl)methylamino]-2-oxidanylidene-ethyl]-1,2-dimethyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: N-[2-[(3-bromophenyl)methylamino]-2-oxo-ethyl]-1,2-dimethyl-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: N-[2-[(3-bromophenyl)methylamino]-2-oxoethyl]-1,2-dimethyl-4-methylsulfonyl-6-oxo-2-piperazinecarboxamide IUPAC Name: N-[2-[(3-bromophenyl)methylamino]-2-oxoethyl]-1,2-dimethyl-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-[2-[(3-bromobenzyl)amino]-2-keto-ethyl]-6-keto-4-mesyl-1,2-dimethyl-piperazine-2-carboxamide Formula: C17H23BrN4O5S MolecularWeight: 475.35732

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC(=O)N1C)S(=O)(=O)C)C(=O)NCC(=O)NCC2=CC(=CC=C2)Br

Isomeric SMILES

CC1(CN(CC(=O)N1C)S(=O)(=O)C)C(=O)NCC(=O)NCC2=CC(=CC=C2)Br

InChI

InChI=1S/C17H23BrN4O5S/c1-17(11-22(28(3,26)27)10-15(24)21(17)2)16(25)20-9-14(23)19-8-12-5-4-6-13(18)7-12/h4-7H,8-11H2,1-3H3,(H,19,23)(H,20,25)