2-[4-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpiperazin-1-yl]-N-cyclopropyl-propanamide

Systemtic Name: 2-[4-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpiperazin-1-yl]-N-cyclopropyl-propanamide Openeye Name: 2-[4-(2-bromo-4,5-dimethoxy-phenyl)sulfonylpiperazin-1-yl]-N-cyclopropyl-propanamide CAS Name: 2-[4-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]-N-cyclopropylpropanamide IUPAC Name: 2-[4-(2-bromo-4,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-N-cyclopropylpropanamide Traditional Name: 2-[4-(2-bromo-4,5-dimethoxy-phenyl)sulfonylpiperazino]-N-cyclopropyl-propionamide Formula: C18H26BrN3O5S MolecularWeight: 476.38514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)OC)OC)Br

Isomeric SMILES

CC(C(=O)NC1CC1)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)OC)OC)Br

InChI

InChI=1S/C18H26BrN3O5S/c1-12(18(23)20-13-4-5-13)21-6-8-22(9-7-21)28(24,25)17-11-16(27-3)15(26-2)10-14(17)19/h10-13H,4-9H2,1-3H3,(H,20,23)