1-[(3-bromophenyl)methylsulfonyl]-N-(9-ethylcarbazol-3-yl)piperidine-4-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methylsulfonyl]-N-(9-ethylcarbazol-3-yl)piperidine-4-carboxamide Openeye Name: 1-[(3-bromophenyl)methylsulfonyl]-N-(9-ethylcarbazol-3-yl)piperidine-4-carboxamide CAS Name: 1-[(3-bromophenyl)methylsulfonyl]-N-(9-ethyl-3-carbazolyl)-4-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methylsulfonyl]-N-(9-ethylcarbazol-3-yl)piperidine-4-carboxamide Traditional Name: 1-(3-bromobenzyl)sulfonyl-N-(9-ethylcarbazol-3-yl)isonipecotamide Formula: C27H28BrN3O3S MolecularWeight: 554.49852

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC(=CC=C4)Br)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC(=CC=C4)Br)C5=CC=CC=C51

InChI

InChI=1S/C27H28BrN3O3S/c1-2-31-25-9-4-3-8-23(25)24-17-22(10-11-26(24)31)29-27(32)20-12-14-30(15-13-20)35(33,34)18-19-6-5-7-21(28)16-19/h3-11,16-17,20H,2,12-15,18H2,1H3,(H,29,32)