N-(3-chlorophenyl)-4-(5-methyl-2-oxidanyl-phenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(3-chlorophenyl)-4-(5-methyl-2-oxidanyl-phenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(3-chlorophenyl)-4-(2-hydroxy-5-methyl-phenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-(3-chlorophenyl)-4-(2-hydroxy-5-methylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(3-chlorophenyl)-4-(2-hydroxy-5-methylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(3-chlorophenyl)-4-(2-hydroxy-5-methyl-phenyl)sulfonyl-piperazine-1-carboxamide Formula: C18H20ClN3O4S MolecularWeight: 409.8871

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)S(=O)(=O)N2CCN(CC2)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)O)S(=O)(=O)N2CCN(CC2)C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H20ClN3O4S/c1-13-5-6-16(23)17(11-13)27(25,26)22-9-7-21(8-10-22)18(24)20-15-4-2-3-14(19)12-15/h2-6,11-12,23H,7-10H2,1H3,(H,20,24)