4-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-N-phenethyl-piperazine-1-carboxamide

Systemtic Name: 4-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-N-phenethyl-piperazine-1-carboxamide Openeye Name: 4-(4-bromo-2-chloro-phenyl)sulfonyl-N-phenethyl-piperazine-1-carboxamide CAS Name: 4-(4-bromo-2-chlorophenyl)sulfonyl-N-phenethyl-1-piperazinecarboxamide IUPAC Name: 4-(4-bromo-2-chlorophenyl)sulfonyl-N-phenethylpiperazine-1-carboxamide Traditional Name: 4-(4-bromo-2-chloro-phenyl)sulfonyl-N-phenethyl-piperazine-1-carboxamide Formula: C19H21BrClN3O3S MolecularWeight: 486.81034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCCC2=CC=CC=C2)S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1CN(CCN1C(=O)NCCC2=CC=CC=C2)S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C19H21BrClN3O3S/c20-16-6-7-18(17(21)14-16)28(26,27)24-12-10-23(11-13-24)19(25)22-9-8-15-4-2-1-3-5-15/h1-7,14H,8-13H2,(H,22,25)