4-azanyl-5-chloranyl-N-[3-methoxy-1-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)amino]ethyl]piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide

Systemtic Name: 4-azanyl-5-chloranyl-N-[3-methoxy-1-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)amino]ethyl]piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide Openeye Name: 4-amino-5-chloro-N-[3-methoxy-1-[2-[(4-oxo-1H-quinazolin-2-yl)amino]ethyl]-4-piperidyl]-2,3-dihydrobenzofuran-7-carboxamide CAS Name: 4-amino-5-chloro-N-[3-methoxy-1-[2-[(4-oxo-1H-quinazolin-2-yl)amino]ethyl]-4-piperidinyl]-2,3-dihydrobenzofuran-7-carboxamide IUPAC Name: 4-amino-5-chloro-N-[3-methoxy-1-[2-[(4-oxo-1H-quinazolin-2-yl)amino]ethyl]piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide Traditional Name: 4-amino-5-chloro-N-[1-[2-[(4-keto-1H-quinazolin-2-yl)amino]ethyl]-3-methoxy-4-piperidyl]coumaran-7-carboxamide Formula: C25H29ClN6O4 MolecularWeight: 512.98856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCC1NC(=O)C2=CC(=C(C3=C2OCC3)N)Cl)CCNC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

COC1CN(CCC1NC(=O)C2=CC(=C(C3=C2OCC3)N)Cl)CCNC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C25H29ClN6O4/c1-35-20-13-32(10-8-28-25-30-18-5-3-2-4-14(18)23(33)31-25)9-6-19(20)29-24(34)16-12-17(26)21(27)15-7-11-36-22(15)16/h2-5,12,19-20H,6-11,13,27H2,1H3,(H,29,34)(H2,28,30,31,33)