(3R)-N-[(Z)-(5-bromanylthiophen-2-yl)methylideneamino]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-[(Z)-(5-bromanylthiophen-2-yl)methylideneamino]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-[(Z)-(5-bromo-2-thienyl)methyleneamino]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3R)-N-[(Z)-(5-bromo-2-thiophenyl)methylideneamino]-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-[(Z)-(5-bromothiophen-2-yl)methylideneamino]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-[(Z)-(5-bromo-2-thienyl)methyleneamino]-1-tosyl-nipecotamide Formula: C18H20BrN3O3S2 MolecularWeight: 470.4037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NN=CC3=CC=C(S3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)N/N=C\C3=CC=C(S3)Br

InChI

InChI=1S/C18H20BrN3O3S2/c1-13-4-7-16(8-5-13)27(24,25)22-10-2-3-14(12-22)18(23)21-20-11-15-6-9-17(19)26-15/h4-9,11,14H,2-3,10,12H2,1H3,(H,21,23)/b20-11-/t14-/m1/s1