2-[2-methyl-1-[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methoxy]phenyl]carbonyl-indol-4-yl]-N-methylsulfonyl-ethanamide

Systemtic Name: 2-[2-methyl-1-[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methoxy]phenyl]carbonyl-indol-4-yl]-N-methylsulfonyl-ethanamide Openeye Name: 2-[2-methyl-1-[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methoxy]benzoyl]indol-4-yl]-N-methylsulfonyl-acetamide CAS Name: 2-[2-methyl-1-[[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methoxy]phenyl]-oxomethyl]-4-indolyl]-N-methylsulfonylacetamide IUPAC Name: 2-[2-methyl-1-[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methoxy]benzoyl]indol-4-yl]-N-methylsulfonylacetamide Traditional Name: N-mesyl-2-[2-methyl-1-[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methoxy]benzoyl]indol-4-yl]acetamide Formula: C29H29N3O6S MolecularWeight: 547.62206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCC4CN(C5=CC=CC=C5O4)C)CC(=O)NS(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCC4CN(C5=CC=CC=C5O4)C)CC(=O)NS(=O)(=O)C

InChI

InChI=1S/C29H29N3O6S/c1-19-15-24-21(16-28(33)30-39(3,35)36)7-6-9-25(24)32(19)29(34)20-11-13-22(14-12-20)37-18-23-17-31(2)26-8-4-5-10-27(26)38-23/h4-15,23H,16-18H2,1-3H3,(H,30,33)