N-[4-[(4-azanyl-4-oxidanylidene-butyl)amino]-4-oxidanylidene-butyl]-3-bromanyl-1,2-oxazole-5-carboxamide

Systemtic Name: N-[4-[(4-azanyl-4-oxidanylidene-butyl)amino]-4-oxidanylidene-butyl]-3-bromanyl-1,2-oxazole-5-carboxamide Openeye Name: N-[4-[(4-amino-4-oxo-butyl)amino]-4-oxo-butyl]-3-bromo-isoxazole-5-carboxamide CAS Name: N-[4-[(4-amino-4-oxobutyl)amino]-4-oxobutyl]-3-bromo-5-isoxazolecarboxamide IUPAC Name: N-[4-[(4-amino-4-oxobutyl)amino]-4-oxobutyl]-3-bromo-1,2-oxazole-5-carboxamide Traditional Name: N-[4-[(4-amino-4-keto-butyl)amino]-4-keto-butyl]-3-bromo-isoxazole-5-carboxamide Formula: C12H17BrN4O4 MolecularWeight: 361.19178

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(ON=C1Br)C(=O)NCCCC(=O)NCCCC(=O)N

Isomeric SMILES

C1=C(ON=C1Br)C(=O)NCCCC(=O)NCCCC(=O)N

InChI

InChI=1S/C12H17BrN4O4/c13-9-7-8(21-17-9)12(20)16-6-2-4-11(19)15-5-1-3-10(14)18/h7H,1-6H2,(H2,14,18)(H,15,19)(H,16,20)