3-[2-[4-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 3-[2-[4-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanoylamino]-N-cyclopropyl-benzamide Openeye Name: N-cyclopropyl-3-[[2-[4-[2-oxo-2-(sec-butylamino)ethyl]piperazin-1-yl]acetyl]amino]benzamide CAS Name: 3-[[2-[4-[2-(butan-2-ylamino)-2-oxoethyl]-1-piperazinyl]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 3-[[2-[4-[2-(butan-2-ylamino)-2-oxoethyl]piperazin-1-yl]acetyl]amino]-N-cyclopropylbenzamide Traditional Name: N-cyclopropyl-3-[[2-[4-[2-keto-2-(sec-butylamino)ethyl]piperazino]acetyl]amino]benzamide Formula: C22H33N5O3 MolecularWeight: 415.52912

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN1CCN(CC1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

Isomeric SMILES

CCC(C)NC(=O)CN1CCN(CC1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

InChI

InChI=1S/C22H33N5O3/c1-3-16(2)23-20(28)14-26-9-11-27(12-10-26)15-21(29)24-19-6-4-5-17(13-19)22(30)25-18-7-8-18/h4-6,13,16,18H,3,7-12,14-15H2,1-2H3,(H,23,28)(H,24,29)(H,25,30)