N-(5-bromanyl-2-oxidanylidene-3H-furan-4-yl)-5-(4-carbamimidoylphenyl)pentanamide

Systemtic Name: N-(5-bromanyl-2-oxidanylidene-3H-furan-4-yl)-5-(4-carbamimidoylphenyl)pentanamide Openeye Name: N-(5-bromo-2-oxo-3H-furan-4-yl)-5-(4-carbamimidoylphenyl)pentanamide CAS Name: N-(5-bromo-2-oxo-3H-furan-4-yl)-5-(4-carbamimidoylphenyl)pentanamide IUPAC Name: N-(5-bromo-2-oxo-3H-furan-4-yl)-5-(4-carbamimidoylphenyl)pentanamide Traditional Name: 5-(4-amidinophenyl)-N-(5-bromo-2-keto-3H-furan-4-yl)valeramide Formula: C16H18BrN3O3 MolecularWeight: 380.23642

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(OC1=O)Br)NC(=O)CCCCC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1C(=C(OC1=O)Br)NC(=O)CCCCC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C16H18BrN3O3/c17-15-12(9-14(22)23-15)20-13(21)4-2-1-3-10-5-7-11(8-6-10)16(18)19/h5-8H,1-4,9H2,(H3,18,19)(H,20,21)