2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]-N-(2-methyl-3-oxidanylidene-butyl)ethanamide

Systemtic Name: 2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]-N-(2-methyl-3-oxidanylidene-butyl)ethanamide Openeye Name: 2-[3-(4-carbamimidoylphenyl)-4,5-dihydroisoxazol-5-yl]-N-(2-methyl-3-oxo-butyl)acetamide CAS Name: 2-[3-(4-carbamimidoylphenyl)-4,5-dihydroisoxazol-5-yl]-N-(2-methyl-3-oxobutyl)acetamide IUPAC Name: 2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]-N-(2-methyl-3-oxobutyl)acetamide Traditional Name: 2-[3-(4-amidinophenyl)-2-isoxazolin-5-yl]-N-(3-keto-2-methyl-butyl)acetamide Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CC1CC(=NO1)C2=CC=C(C=C2)C(=N)N)C(=O)C

Isomeric SMILES

CC(CNC(=O)CC1CC(=NO1)C2=CC=C(C=C2)C(=N)N)C(=O)C

InChI

InChI=1S/C17H22N4O3/c1-10(11(2)22)9-20-16(23)8-14-7-15(21-24-14)12-3-5-13(6-4-12)17(18)19/h3-6,10,14H,7-9H2,1-2H3,(H3,18,19)(H,20,23)