6-chloranyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: 6-chloranyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: 6-chloro-N-[3-(2-methylpyrimidin-4-yl)phenyl]chromane-3-carboxamide CAS Name: 6-chloro-N-[3-(2-methyl-4-pyrimidinyl)phenyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: 6-chloro-N-[3-(2-methylpyrimidin-4-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: 6-chloro-N-[3-(2-methylpyrimidin-4-yl)phenyl]chroman-3-carboxamide Formula: C21H18ClN3O2 MolecularWeight: 379.83952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)C3CC4=C(C=CC(=C4)Cl)OC3

Isomeric SMILES

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)C3CC4=C(C=CC(=C4)Cl)OC3

InChI

InChI=1S/C21H18ClN3O2/c1-13-23-8-7-19(24-13)14-3-2-4-18(11-14)25-21(26)16-9-15-10-17(22)5-6-20(15)27-12-16/h2-8,10-11,16H,9,12H2,1H3,(H,25,26)