2-(2-acetamidoethanoylamino)-N-[1-azanyl-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]-3-phenyl-propanamide

Systemtic Name: 2-(2-acetamidoethanoylamino)-N-[1-azanyl-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]-3-phenyl-propanamide Openeye Name: 2-[(2-acetamidoacetyl)amino]-N-[2-amino-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]-3-phenyl-propanamide CAS Name: 2-[(2-acetamido-1-oxoethyl)amino]-N-[1-amino-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-3-phenylpropanamide IUPAC Name: 2-[(2-acetamidoacetyl)amino]-N-[1-amino-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-3-phenylpropanamide Traditional Name: 2-[(2-acetamidoacetyl)amino]-N-[2-amino-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]-3-phenyl-propionamide Formula: C19H24N6O4 MolecularWeight: 400.43166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CN=CN2)C(=O)N

Isomeric SMILES

CC(=O)NCC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CN=CN2)C(=O)N

InChI

InChI=1S/C19H24N6O4/c1-12(26)22-10-17(27)24-16(7-13-5-3-2-4-6-13)19(29)25-15(18(20)28)8-14-9-21-11-23-14/h2-6,9,11,15-16H,7-8,10H2,1H3,(H2,20,28)(H,21,23)(H,22,26)(H,24,27)(H,25,29)