1-azanyl-N-[2-oxidanylidene-2-[7-(2-sulfamoylphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]isoquinoline-7-carboxamide

Systemtic Name: 1-azanyl-N-[2-oxidanylidene-2-[7-(2-sulfamoylphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]isoquinoline-7-carboxamide Openeye Name: 1-amino-N-[2-oxo-2-[7-(2-sulfamoylphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]isoquinoline-7-carboxamide CAS Name: 1-amino-N-[2-oxo-2-[7-(2-sulfamoylphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]-7-isoquinolinecarboxamide IUPAC Name: 1-amino-N-[2-oxo-2-[7-(2-sulfamoylphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]isoquinoline-7-carboxamide Traditional Name: 1-amino-N-[2-keto-2-[7-(2-sulfamoylphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]isoquinoline-7-carboxamide Formula: C26H23N5O5S MolecularWeight: 517.55632

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(N1C(=O)CNC(=O)C3=CC4=C(C=C3)C=CN=C4N)C=CC(=C2)C5=CC=CC=C5S(=O)(=O)N

Isomeric SMILES

C1COC2=C(N1C(=O)CNC(=O)C3=CC4=C(C=C3)C=CN=C4N)C=CC(=C2)C5=CC=CC=C5S(=O)(=O)N

InChI

InChI=1S/C26H23N5O5S/c27-25-20-13-18(6-5-16(20)9-10-29-25)26(33)30-15-24(32)31-11-12-36-22-14-17(7-8-21(22)31)19-3-1-2-4-23(19)37(28,34)35/h1-10,13-14H,11-12,15H2,(H2,27,29)(H,30,33)(H2,28,34,35)