N-(1-azanyl-1-oxidanylidene-propan-2-yl)-N-imidazol-1-yl-4-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-(phenylmethyl)butanamide

Systemtic Name: N-(1-azanyl-1-oxidanylidene-propan-2-yl)-N-imidazol-1-yl-4-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-(phenylmethyl)butanamide Openeye Name: N-(2-amino-1-methyl-2-oxo-ethyl)-2-benzyl-N-imidazol-1-yl-4-(4-methylpiperazin-1-yl)-4-oxo-butanamide CAS Name: N-(1-amino-1-oxopropan-2-yl)-N-(1-imidazolyl)-4-(4-methyl-1-piperazinyl)-4-oxo-2-(phenylmethyl)butanamide IUPAC Name: N-(1-amino-1-oxopropan-2-yl)-2-benzyl-N-imidazol-1-yl-4-(4-methylpiperazin-1-yl)-4-oxobutanamide Traditional Name: N-(2-amino-2-keto-1-methyl-ethyl)-2-benzyl-N-imidazol-1-yl-4-keto-4-(4-methylpiperazino)butyramide Formula: C22H30N6O3 MolecularWeight: 426.512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)N(C(=O)C(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)C)N3C=CN=C3

Isomeric SMILES

CC(C(=O)N)N(C(=O)C(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)C)N3C=CN=C3

InChI

InChI=1S/C22H30N6O3/c1-17(21(23)30)28(27-9-8-24-16-27)22(31)19(14-18-6-4-3-5-7-18)15-20(29)26-12-10-25(2)11-13-26/h3-9,16-17,19H,10-15H2,1-2H3,(H2,23,30)