N-[(4-chlorophenyl)methyl]-4-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-(p-tolylsulfonyl)piperazine-1-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-4-(4-methylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-(4-methylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(4-chlorobenzyl)-4-tosyl-piperazine-1-carboxamide Formula: C19H22ClN3O3S MolecularWeight: 407.91428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3O3S/c1-15-2-8-18(9-3-15)27(25,26)23-12-10-22(11-13-23)19(24)21-14-16-4-6-17(20)7-5-16/h2-9H,10-14H2,1H3,(H,21,24)