N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-benzylsulfonyl-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[[4-(2-methyl-1-imidazolyl)phenyl]methyl]-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-benzylsulfonyl-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-benzylsulfonyl-N-[4-(2-methylimidazol-1-yl)benzyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C27H26N4O4S MolecularWeight: 502.58474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(C=C2)CNC(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

CC1=NC=CN1C2=CC=C(C=C2)CNC(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C27H26N4O4S/c1-20-28-15-16-30(20)23-13-11-21(12-14-23)17-29-27(32)26-18-31(24-9-5-6-10-25(24)35-26)36(33,34)19-22-7-3-2-4-8-22/h2-16,26H,17-19H2,1H3,(H,29,32)