2-(2-azanylethanoylamino)-N-(3-cyclohexyl-2-methanoyl-aziridin-2-yl)-3-methyl-N-pyrimidin-4-yl-butanamide

Systemtic Name: 2-(2-azanylethanoylamino)-N-(3-cyclohexyl-2-methanoyl-aziridin-2-yl)-3-methyl-N-pyrimidin-4-yl-butanamide Openeye Name: 2-[(2-aminoacetyl)amino]-N-(3-cyclohexyl-2-formyl-aziridin-2-yl)-3-methyl-N-pyrimidin-4-yl-butanamide CAS Name: 2-[(2-amino-1-oxoethyl)amino]-N-(3-cyclohexyl-2-formyl-2-aziridinyl)-3-methyl-N-(4-pyrimidinyl)butanamide IUPAC Name: 2-[(2-aminoacetyl)amino]-N-(3-cyclohexyl-2-formylaziridin-2-yl)-3-methyl-N-pyrimidin-4-ylbutanamide Traditional Name: N-(3-cyclohexyl-2-formyl-ethylenimin-2-yl)-2-(glycylamino)-3-methyl-N-(4-pyrimidyl)butyramide Formula: C20H30N6O3 MolecularWeight: 402.4906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C1=NC=NC=C1)C2(C(N2)C3CCCCC3)C=O)NC(=O)CN

Isomeric SMILES

CC(C)C(C(=O)N(C1=NC=NC=C1)C2(C(N2)C3CCCCC3)C=O)NC(=O)CN

InChI

InChI=1S/C20H30N6O3/c1-13(2)17(24-16(28)10-21)19(29)26(15-8-9-22-12-23-15)20(11-27)18(25-20)14-6-4-3-5-7-14/h8-9,11-14,17-18,25H,3-7,10,21H2,1-2H3,(H,24,28)