N-(3-azanyl-3-oxidanylidene-propyl)-3-chloranyl-N-cyclobutyl-5-[2-(pyridin-4-ylamino)ethoxy]benzamide

Systemtic Name: N-(3-azanyl-3-oxidanylidene-propyl)-3-chloranyl-N-cyclobutyl-5-[2-(pyridin-4-ylamino)ethoxy]benzamide Openeye Name: N-(3-amino-3-oxo-propyl)-3-chloro-N-cyclobutyl-5-[2-(4-pyridylamino)ethoxy]benzamide CAS Name: N-(3-amino-3-oxopropyl)-3-chloro-N-cyclobutyl-5-[2-(pyridin-4-ylamino)ethoxy]benzamide IUPAC Name: N-(3-amino-3-oxopropyl)-3-chloro-N-cyclobutyl-5-[2-(pyridin-4-ylamino)ethoxy]benzamide Traditional Name: N-(3-amino-3-keto-propyl)-3-chloro-N-cyclobutyl-5-[2-(4-pyridylamino)ethoxy]benzamide Formula: C21H25ClN4O3 MolecularWeight: 416.9012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N(CCC(=O)N)C(=O)C2=CC(=CC(=C2)Cl)OCCNC3=CC=NC=C3

Isomeric SMILES

C1CC(C1)N(CCC(=O)N)C(=O)C2=CC(=CC(=C2)Cl)OCCNC3=CC=NC=C3

InChI

InChI=1S/C21H25ClN4O3/c22-16-12-15(21(28)26(10-6-20(23)27)18-2-1-3-18)13-19(14-16)29-11-9-25-17-4-7-24-8-5-17/h4-5,7-8,12-14,18H,1-3,6,9-11H2,(H2,23,27)(H,24,25)