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

Systemtic Name: N-butyl-2-methyl-4-[3-methyl-2-(thiophen-2-ylcarbonylamino)pentanoyl]piperazine-1-carboxamide Openeye Name: N-butyl-2-methyl-4-[3-methyl-2-(thiophene-2-carbonylamino)pentanoyl]piperazine-1-carboxamide CAS Name: N-butyl-2-methyl-4-[3-methyl-1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]pentyl]-1-piperazinecarboxamide IUPAC Name: N-butyl-2-methyl-4-[3-methyl-2-(thiophene-2-carbonylamino)pentanoyl]piperazine-1-carboxamide Traditional Name: N-butyl-2-methyl-4-[3-methyl-2-(2-thenoylamino)pentanoyl]piperazine-1-carboxamide Formula: C21H34N4O3S MolecularWeight: 422.58466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCN(CC1C)C(=O)C(C(C)CC)NC(=O)C2=CC=CS2

Isomeric SMILES

CCCCNC(=O)N1CCN(CC1C)C(=O)C(C(C)CC)NC(=O)C2=CC=CS2

InChI

InChI=1S/C21H34N4O3S/c1-5-7-10-22-21(28)25-12-11-24(14-16(25)4)20(27)18(15(3)6-2)23-19(26)17-9-8-13-29-17/h8-9,13,15-16,18H,5-7,10-12,14H2,1-4H3,(H,22,28)(H,23,26)