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

Systemtic Name: N-butyl-2-methyl-4-[3-methyl-2-(3-methylbutanoylamino)pentanoyl]piperazine-1-carboxamide Openeye Name: N-butyl-2-methyl-4-[3-methyl-2-(3-methylbutanoylamino)pentanoyl]piperazine-1-carboxamide CAS Name: N-butyl-2-methyl-4-[3-methyl-2-[(3-methyl-1-oxobutyl)amino]-1-oxopentyl]-1-piperazinecarboxamide IUPAC Name: N-butyl-2-methyl-4-[3-methyl-2-(3-methylbutanoylamino)pentanoyl]piperazine-1-carboxamide Traditional Name: N-butyl-4-[2-(isovalerylamino)-3-methyl-pentanoyl]-2-methyl-piperazine-1-carboxamide Formula: C21H40N4O3 MolecularWeight: 396.5673

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCN(CC1C)C(=O)C(C(C)CC)NC(=O)CC(C)C

Isomeric SMILES

CCCCNC(=O)N1CCN(CC1C)C(=O)C(C(C)CC)NC(=O)CC(C)C

InChI

InChI=1S/C21H40N4O3/c1-7-9-10-22-21(28)25-12-11-24(14-17(25)6)20(27)19(16(5)8-2)23-18(26)13-15(3)4/h15-17,19H,7-14H2,1-6H3,(H,22,28)(H,23,26)