4-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[3-[4-(1-azepanylsulfonyl)phenyl]-1-oxopropyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N3O5S/c1-26-25(30)23-18-28(21-8-4-5-9-22(21)33-23)24(29)15-12-19-10-13-20(14-11-19)34(31,32)27-16-6-2-3-7-17-27/h4-5,8-11,13-14,23H,2-3,6-7,12,15-18H2,1H3,(H,26,30)