(3S)-1-(4-bromophenyl)sulfonyl-N-[(1S)-1-cyclopropylethyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-bromophenyl)sulfonyl-N-[(1S)-1-cyclopropylethyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-bromophenyl)sulfonyl-N-[(1S)-1-cyclopropylethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-bromophenyl)sulfonyl-N-[(1S)-1-cyclopropylethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-bromophenyl)sulfonyl-N-[(1S)-1-cyclopropylethyl]piperidine-3-carboxamide Traditional Name: (3S)-1-brosyl-N-[(1S)-1-cyclopropylethyl]nipecotamide Formula: C17H23BrN2O3S MolecularWeight: 415.34512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C[C@@H](C1CC1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H23BrN2O3S/c1-12(13-4-5-13)19-17(21)14-3-2-10-20(11-14)24(22,23)16-8-6-15(18)7-9-16/h6-9,12-14H,2-5,10-11H2,1H3,(H,19,21)/t12-,14-/m0/s1