N-(2,3-dimethylphenyl)-2-[4-[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[4-[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[4-[2-(isobutylcarbamoylamino)-2-oxo-ethyl]piperazin-1-yl]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[4-[2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl]-1-piperazinyl]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[4-[2-(2-methylpropylcarbamoylamino)-2-oxoethyl]piperazin-1-yl]acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[4-[2-(isobutylcarbamoylamino)-2-keto-ethyl]piperazino]acetamide Formula: C21H33N5O3 MolecularWeight: 403.51842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CN2CCN(CC2)CC(=O)NC(=O)NCC(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CN2CCN(CC2)CC(=O)NC(=O)NCC(C)C)C

InChI

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