2-[[2-acetamido-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-N-(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-3-methyl-pentanamide

Systemtic Name: 2-[[2-acetamido-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-N-(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-3-methyl-pentanamide Openeye Name: 2-[(2-acetamido-5-guanidino-pentanoyl)amino]-N-(2-amino-1-benzyl-2-oxo-ethyl)-3-methyl-pentanamide CAS Name: 2-[[2-acetamido-5-(diaminomethylideneamino)-1-oxopentyl]amino]-N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-methylpentanamide IUPAC Name: 2-[[2-acetamido-5-(diaminomethylideneamino)pentanoyl]amino]-N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-methylpentanamide Traditional Name: 2-[(2-acetamido-5-guanidino-pentanoyl)amino]-N-(2-amino-1-benzyl-2-keto-ethyl)-3-methyl-valeramide Formula: C23H37N7O4 MolecularWeight: 475.58438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)N)NC(=O)C(CCCN=C(N)N)NC(=O)C

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)N)NC(=O)C(CCCN=C(N)N)NC(=O)C

InChI

InChI=1S/C23H37N7O4/c1-4-14(2)19(22(34)29-18(20(24)32)13-16-9-6-5-7-10-16)30-21(33)17(28-15(3)31)11-8-12-27-23(25)26/h5-7,9-10,14,17-19H,4,8,11-13H2,1-3H3,(H2,24,32)(H,28,31)(H,29,34)(H,30,33)(H4,25,26,27)