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

Systemtic Name: N-(2-acetamido-3-oxidanylidene-butyl)-2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]ethanamide Openeye Name: N-(2-acetamido-3-oxo-butyl)-2-[3-(4-carbamimidoylphenyl)-4,5-dihydroisoxazol-5-yl]acetamide CAS Name: N-(2-acetamido-3-oxobutyl)-2-[3-(4-carbamimidoylphenyl)-4,5-dihydroisoxazol-5-yl]acetamide IUPAC Name: N-(2-acetamido-3-oxobutyl)-2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetamide Traditional Name: N-(2-acetamido-3-keto-butyl)-2-[3-(4-amidinophenyl)-2-isoxazolin-5-yl]acetamide Formula: C18H23N5O4 MolecularWeight: 373.40632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N5O4/c1-10(24)16(22-11(2)25)9-21-17(26)8-14-7-15(23-27-14)12-3-5-13(6-4-12)18(19)20/h3-6,14,16H,7-9H2,1-2H3,(H3,19,20)(H,21,26)(H,22,25)