4-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-N-[(1R)-1-pyridin-3-ylethyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-N-[(1R)-1-pyridin-3-ylethyl]piperazine-1-carboxamide Openeye Name: 4-(4-bromo-2-chloro-phenyl)sulfonyl-N-[(1R)-1-(3-pyridyl)ethyl]piperazine-1-carboxamide CAS Name: 4-(4-bromo-2-chlorophenyl)sulfonyl-N-[(1R)-1-(3-pyridinyl)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-bromo-2-chlorophenyl)sulfonyl-N-[(1R)-1-pyridin-3-ylethyl]piperazine-1-carboxamide Traditional Name: 4-(4-bromo-2-chloro-phenyl)sulfonyl-N-[(1R)-1-(3-pyridyl)ethyl]piperazine-1-carboxamide Formula: C18H20BrClN4O3S MolecularWeight: 487.7984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C[C@H](C1=CN=CC=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C18H20BrClN4O3S/c1-13(14-3-2-6-21-12-14)22-18(25)23-7-9-24(10-8-23)28(26,27)17-5-4-15(19)11-16(17)20/h2-6,11-13H,7-10H2,1H3,(H,22,25)/t13-/m1/s1