6-chloranyl-N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]-2H-chromene-3-carboxamide

Systemtic Name: 6-chloranyl-N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]-2H-chromene-3-carboxamide Openeye Name: 6-chloro-N-[(1-pyrimidin-2-yl-3-piperidyl)methyl]-2H-chromene-3-carboxamide CAS Name: 6-chloro-N-[[1-(2-pyrimidinyl)-3-piperidinyl]methyl]-2H-1-benzopyran-3-carboxamide IUPAC Name: 6-chloro-N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]-2H-chromene-3-carboxamide Traditional Name: 6-chloro-N-[[1-(2-pyrimidyl)-3-piperidyl]methyl]-2H-chromene-3-carboxamide Formula: C20H21ClN4O2 MolecularWeight: 384.85934

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)CNC(=O)C3=CC4=C(C=CC(=C4)Cl)OC3

Isomeric SMILES

C1CC(CN(C1)C2=NC=CC=N2)CNC(=O)C3=CC4=C(C=CC(=C4)Cl)OC3

InChI

InChI=1S/C20H21ClN4O2/c21-17-4-5-18-15(10-17)9-16(13-27-18)19(26)24-11-14-3-1-8-25(12-14)20-22-6-2-7-23-20/h2,4-7,9-10,14H,1,3,8,11-13H2,(H,24,26)