N-cyclohexyl-2-methyl-4-[3-methyl-2-(3-methylbutanoylamino)pentanoyl]piperazine-1-carboxamide

Systemtic Name: N-cyclohexyl-2-methyl-4-[3-methyl-2-(3-methylbutanoylamino)pentanoyl]piperazine-1-carboxamide Openeye Name: N-cyclohexyl-2-methyl-4-[3-methyl-2-(3-methylbutanoylamino)pentanoyl]piperazine-1-carboxamide CAS Name: N-cyclohexyl-2-methyl-4-[3-methyl-2-[(3-methyl-1-oxobutyl)amino]-1-oxopentyl]-1-piperazinecarboxamide IUPAC Name: N-cyclohexyl-2-methyl-4-[3-methyl-2-(3-methylbutanoylamino)pentanoyl]piperazine-1-carboxamide Traditional Name: N-cyclohexyl-4-[2-(isovalerylamino)-3-methyl-pentanoyl]-2-methyl-piperazine-1-carboxamide Formula: C23H42N4O3 MolecularWeight: 422.60458

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(C(C1)C)C(=O)NC2CCCCC2)NC(=O)CC(C)C

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(C(C1)C)C(=O)NC2CCCCC2)NC(=O)CC(C)C

InChI

InChI=1S/C23H42N4O3/c1-6-17(4)21(25-20(28)14-16(2)3)22(29)26-12-13-27(18(5)15-26)23(30)24-19-10-8-7-9-11-19/h16-19,21H,6-15H2,1-5H3,(H,24,30)(H,25,28)