N-(2-dimethylaminoethyl)-N-methyl-5-[3-oxidanylidene-3-[(phenylmethyl)amino]-2-(propanoylamino)propyl]imidazole-1-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-methyl-5-[3-oxidanylidene-3-[(phenylmethyl)amino]-2-(propanoylamino)propyl]imidazole-1-carboxamide Openeye Name: 5-[3-(benzylamino)-3-oxo-2-(propanoylamino)propyl]-N-(2-dimethylaminoethyl)-N-methyl-imidazole-1-carboxamide CAS Name: N-(2-dimethylaminoethyl)-N-methyl-5-[3-oxo-2-(1-oxopropylamino)-3-[(phenylmethyl)amino]propyl]-1-imidazolecarboxamide IUPAC Name: 5-[3-(benzylamino)-3-oxo-2-(propanoylamino)propyl]-N-(2-dimethylaminoethyl)-N-methylimidazole-1-carboxamide Traditional Name: 5-[3-(benzylamino)-3-keto-2-propionamido-propyl]-N-(2-dimethylaminoethyl)-N-methyl-imidazole-1-carboxamide Formula: C22H32N6O3 MolecularWeight: 428.52788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(CC1=CN=CN1C(=O)N(C)CCN(C)C)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCC(=O)NC(CC1=CN=CN1C(=O)N(C)CCN(C)C)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C22H32N6O3/c1-5-20(29)25-19(21(30)24-14-17-9-7-6-8-10-17)13-18-15-23-16-28(18)22(31)27(4)12-11-26(2)3/h6-10,15-16,19H,5,11-14H2,1-4H3,(H,24,30)(H,25,29)