2-[4-[2-(butylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-[(phenylmethyl)carbamoyl]propanamide

Systemtic Name: 2-[4-[2-(butylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-[(phenylmethyl)carbamoyl]propanamide Openeye Name: N-(benzylcarbamoyl)-2-[4-[2-(butylamino)-2-oxo-ethyl]piperazin-1-yl]propanamide CAS Name: 2-[4-[2-(butylamino)-2-oxoethyl]-1-piperazinyl]-N-[oxo-[(phenylmethyl)amino]methyl]propanamide IUPAC Name: N-(benzylcarbamoyl)-2-[4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl]propanamide Traditional Name: N-(benzylcarbamoyl)-2-[4-[2-(butylamino)-2-keto-ethyl]piperazino]propionamide Formula: C21H33N5O3 MolecularWeight: 403.51842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(C)C(=O)NC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(C)C(=O)NC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C21H33N5O3/c1-3-4-10-22-19(27)16-25-11-13-26(14-12-25)17(2)20(28)24-21(29)23-15-18-8-6-5-7-9-18/h5-9,17H,3-4,10-16H2,1-2H3,(H,22,27)(H2,23,24,28,29)