N-(4-bromophenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-(4-bromophenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-N-(4-bromophenyl)thiadiazole-4-carboxamide CAS Name: N-(4-bromophenyl)-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-4-thiadiazolecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-N-(4-bromophenyl)thiadiazole-4-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-N-(4-bromophenyl)thiadiazole-4-carboxamide Formula: C18H15BrN4O2S MolecularWeight: 431.3063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CN(C2=CC=C(C=C2)Br)C(=O)C3=CSN=N3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CN(C2=CC=C(C=C2)Br)C(=O)C3=CSN=N3

InChI

InChI=1S/C18H15BrN4O2S/c19-14-6-8-15(9-7-14)23(18(25)16-12-26-22-21-16)11-17(24)20-10-13-4-2-1-3-5-13/h1-9,12H,10-11H2,(H,20,24)