3-chloranyl-11-oxidanylidene-N-[1-(phenylmethyl)piperidin-4-yl]pyrido[2,1-b]quinazoline-8-carboxamide

Systemtic Name: 3-chloranyl-11-oxidanylidene-N-[1-(phenylmethyl)piperidin-4-yl]pyrido[2,1-b]quinazoline-8-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-3-chloro-11-oxo-pyrido[2,1-b]quinazoline-8-carboxamide CAS Name: 3-chloro-11-oxo-N-[1-(phenylmethyl)-4-piperidinyl]-8-pyrido[2,1-b]quinazolinecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-3-chloro-11-oxopyrido[2,1-b]quinazoline-8-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-3-chloro-11-keto-pyrido[2,1-b]quinazoline-8-carboxamide Formula: C25H23ClN4O2 MolecularWeight: 446.92872

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CN3C(=NC4=C(C3=O)C=CC(=C4)Cl)C=C2)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CN3C(=NC4=C(C3=O)C=CC(=C4)Cl)C=C2)CC5=CC=CC=C5

InChI

InChI=1S/C25H23ClN4O2/c26-19-7-8-21-22(14-19)28-23-9-6-18(16-30(23)25(21)32)24(31)27-20-10-12-29(13-11-20)15-17-4-2-1-3-5-17/h1-9,14,16,20H,10-13,15H2,(H,27,31)