4-azanyl-5-chloranyl-N-[1-[4-[(3-cyanopyridin-2-yl)amino]butyl]-3-methoxy-piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide

Systemtic Name: 4-azanyl-5-chloranyl-N-[1-[4-[(3-cyanopyridin-2-yl)amino]butyl]-3-methoxy-piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide Openeye Name: 4-amino-5-chloro-N-[1-[4-[(3-cyano-2-pyridyl)amino]butyl]-3-methoxy-4-piperidyl]-2,3-dihydrobenzofuran-7-carboxamide CAS Name: 4-amino-5-chloro-N-[1-[4-[(3-cyano-2-pyridinyl)amino]butyl]-3-methoxy-4-piperidinyl]-2,3-dihydrobenzofuran-7-carboxamide IUPAC Name: 4-amino-5-chloro-N-[1-[4-[(3-cyanopyridin-2-yl)amino]butyl]-3-methoxypiperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide Traditional Name: 4-amino-5-chloro-N-[1-[4-[(3-cyano-2-pyridyl)amino]butyl]-3-methoxy-4-piperidyl]coumaran-7-carboxamide Formula: C25H31ClN6O3 MolecularWeight: 499.00504

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCC1NC(=O)C2=CC(=C(C3=C2OCC3)N)Cl)CCCCNC4=C(C=CC=N4)C#N

Isomeric SMILES

COC1CN(CCC1NC(=O)C2=CC(=C(C3=C2OCC3)N)Cl)CCCCNC4=C(C=CC=N4)C#N

InChI

InChI=1S/C25H31ClN6O3/c1-34-21-15-32(10-3-2-8-29-24-16(14-27)5-4-9-30-24)11-6-20(21)31-25(33)18-13-19(26)22(28)17-7-12-35-23(17)18/h4-5,9,13,20-21H,2-3,6-8,10-12,15,28H2,1H3,(H,29,30)(H,31,33)