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

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-1-(4-bromophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]-1-(4-bromobenzoyl)piperidine-4-carboxamide CAS Name: N-[4-(2-amino-2-oxoethyl)-2-thiazolyl]-1-[(4-bromophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-1-(4-bromobenzoyl)piperidine-4-carboxamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)thiazol-2-yl]-1-(4-bromobenzoyl)isonipecotamide Formula: C18H19BrN4O3S MolecularWeight: 451.33746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC(=CS2)CC(=O)N)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC(=CS2)CC(=O)N)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H19BrN4O3S/c19-13-3-1-12(2-4-13)17(26)23-7-5-11(6-8-23)16(25)22-18-21-14(10-27-18)9-15(20)24/h1-4,10-11H,5-9H2,(H2,20,24)(H,21,22,25)