N-[2-[2-azanylethanoyl(phenyl)amino]-3-oxidanyl-butanoyl]-3-carbamimidoyl-benzamide

Systemtic Name: N-[2-[2-azanylethanoyl(phenyl)amino]-3-oxidanyl-butanoyl]-3-carbamimidoyl-benzamide Openeye Name: N-[2-(N-(2-aminoacetyl)anilino)-3-hydroxy-butanoyl]-3-carbamimidoyl-benzamide CAS Name: N-[2-(N-(2-amino-1-oxoethyl)anilino)-3-hydroxy-1-oxobutyl]-3-carbamimidoylbenzamide IUPAC Name: N-[2-(N-(2-aminoacetyl)anilino)-3-hydroxybutanoyl]-3-carbamimidoylbenzamide Traditional Name: 3-amidino-N-[2-(N-glycylanilino)-3-hydroxy-butanoyl]benzamide Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC(=O)C1=CC=CC(=C1)C(=N)N)N(C2=CC=CC=C2)C(=O)CN)O

Isomeric SMILES

CC(C(C(=O)NC(=O)C1=CC=CC(=C1)C(=N)N)N(C2=CC=CC=C2)C(=O)CN)O

InChI

InChI=1S/C20H23N5O4/c1-12(26)17(25(16(27)11-21)15-8-3-2-4-9-15)20(29)24-19(28)14-7-5-6-13(10-14)18(22)23/h2-10,12,17,26H,11,21H2,1H3,(H3,22,23)(H,24,28,29)