4-[1-azanyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-pyridin-4-yl-benzamide

Systemtic Name: 4-[1-azanyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-pyridin-4-yl-benzamide Openeye Name: 4-[1-amino-2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxo-ethyl]-N-(4-pyridyl)benzamide CAS Name: 4-[1-amino-2-[4-(2-hydroxyethyl)-1-piperazinyl]-2-oxoethyl]-N-pyridin-4-ylbenzamide IUPAC Name: 4-[1-amino-2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl]-N-pyridin-4-ylbenzamide Traditional Name: 4-[1-amino-2-[4-(2-hydroxyethyl)piperazino]-2-keto-ethyl]-N-(4-pyridyl)benzamide Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(=O)C(C2=CC=C(C=C2)C(=O)NC3=CC=NC=C3)N

Isomeric SMILES

C1CN(CCN1CCO)C(=O)C(C2=CC=C(C=C2)C(=O)NC3=CC=NC=C3)N

InChI

InChI=1S/C20H25N5O3/c21-18(20(28)25-11-9-24(10-12-25)13-14-26)15-1-3-16(4-2-15)19(27)23-17-5-7-22-8-6-17/h1-8,18,26H,9-14,21H2,(H,22,23,27)