(3S)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-[(1R)-1-cyclopropylethyl]-N-methyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-[(1R)-1-cyclopropylethyl]-N-methyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[(5-bromo-2-thienyl)sulfonyl]-N-[(1R)-1-cyclopropylethyl]-N-methyl-piperidine-3-carboxamide CAS Name: (3S)-1-[(5-bromo-2-thiophenyl)sulfonyl]-N-[(1R)-1-cyclopropylethyl]-N-methyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-(5-bromothiophen-2-yl)sulfonyl-N-[(1R)-1-cyclopropylethyl]-N-methylpiperidine-3-carboxamide Traditional Name: (3S)-1-[(5-bromo-2-thienyl)sulfonyl]-N-[(1R)-1-cyclopropylethyl]-N-methyl-nipecotamide Formula: C16H23BrN2O3S2 MolecularWeight: 435.39942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)N(C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C[C@H](C1CC1)N(C)C(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C16H23BrN2O3S2/c1-11(12-5-6-12)18(2)16(20)13-4-3-9-19(10-13)24(21,22)15-8-7-14(17)23-15/h7-8,11-13H,3-6,9-10H2,1-2H3/t11-,13+/m1/s1