1-(4-bromophenyl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]cyclopropane-1-carboxamide

Systemtic Name: 1-(4-bromophenyl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]cyclopropane-1-carboxamide Openeye Name: 1-(4-bromophenyl)-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]cyclopropanecarboxamide CAS Name: 1-(4-bromophenyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-1-cyclopropanecarboxamide IUPAC Name: 1-(4-bromophenyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]cyclopropane-1-carboxamide Traditional Name: 1-(4-bromophenyl)-N-[2-(4-mesyl-2-nitro-anilino)ethyl]cyclopropanecarboxamide Formula: C19H20BrN3O5S MolecularWeight: 482.3482

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2(CC2)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2(CC2)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H20BrN3O5S/c1-29(27,28)15-6-7-16(17(12-15)23(25)26)21-10-11-22-18(24)19(8-9-19)13-2-4-14(20)5-3-13/h2-7,12,21H,8-11H2,1H3,(H,22,24)