1-(3-chloranyl-2-methyl-phenyl)-2-methyl-4-methylsulfonyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-2-methyl-4-methylsulfonyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide Openeye Name: N-benzyl-1-(3-chloro-2-methyl-phenyl)-2-methyl-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: 1-(3-chloro-2-methylphenyl)-2-methyl-4-methylsulfonyl-6-oxo-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-1-(3-chloro-2-methylphenyl)-2-methyl-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-benzyl-1-(3-chloro-2-methyl-phenyl)-6-keto-4-mesyl-2-methyl-piperazine-2-carboxamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=O)CN(CC2(C)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=O)CN(CC2(C)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C21H24ClN3O4S/c1-15-17(22)10-7-11-18(15)25-19(26)13-24(30(3,28)29)14-21(25,2)20(27)23-12-16-8-5-4-6-9-16/h4-11H,12-14H2,1-3H3,(H,23,27)