(3S)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-(2-methyl-6-propan-2-yl-phenyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-(2-methyl-6-propan-2-yl-phenyl)piperidine-3-carboxamide Openeye Name: (3S)-1-[(5-bromo-2-thienyl)sulfonyl]-N-(2-isopropyl-6-methyl-phenyl)piperidine-3-carboxamide CAS Name: (3S)-1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(2-methyl-6-propan-2-ylphenyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(5-bromothiophen-2-yl)sulfonyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-[(5-bromo-2-thienyl)sulfonyl]-N-(2-isopropyl-6-methyl-phenyl)nipecotamide Formula: C20H25BrN2O3S2 MolecularWeight: 485.4581

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C20H25BrN2O3S2/c1-13(2)16-8-4-6-14(3)19(16)22-20(24)15-7-5-11-23(12-15)28(25,26)18-10-9-17(21)27-18/h4,6,8-10,13,15H,5,7,11-12H2,1-3H3,(H,22,24)/t15-/m0/s1