N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-1-(4-bromophenyl)sulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-1-(4-bromophenyl)sulfonyl-piperidine-2-carboxamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]-1-(4-bromophenyl)sulfonyl-piperidine-2-carboxamide CAS Name: N-[4-(2-amino-2-oxoethyl)-2-thiazolyl]-1-(4-bromophenyl)sulfonyl-2-piperidinecarboxamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-1-(4-bromophenyl)sulfonylpiperidine-2-carboxamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)thiazol-2-yl]-1-brosyl-pipecolinamide Formula: C17H19BrN4O4S2 MolecularWeight: 487.39116

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=NC(=CS2)CC(=O)N)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=NC(=CS2)CC(=O)N)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H19BrN4O4S2/c18-11-4-6-13(7-5-11)28(25,26)22-8-2-1-3-14(22)16(24)21-17-20-12(10-27-17)9-15(19)23/h4-7,10,14H,1-3,8-9H2,(H2,19,23)(H,20,21,24)