6-chloranyl-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 6-chloranyl-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 6-chloro-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 6-chloro-N-[[2-(2-methyl-1-imidazolyl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 6-chloro-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 6-chloro-4-mesyl-N-[2-(2-methylimidazol-1-yl)benzyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H21ClN4O4S MolecularWeight: 460.93384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=CC=C2CNC(=O)C3CN(C4=C(O3)C=CC(=C4)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=NC=CN1C2=CC=CC=C2CNC(=O)C3CN(C4=C(O3)C=CC(=C4)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H21ClN4O4S/c1-14-23-9-10-25(14)17-6-4-3-5-15(17)12-24-21(27)20-13-26(31(2,28)29)18-11-16(22)7-8-19(18)30-20/h3-11,20H,12-13H2,1-2H3,(H,24,27)