5-(6-chloranyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]thiophene-2-carboxamide

Systemtic Name: 5-(6-chloranyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]thiophene-2-carboxamide Openeye Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]thiophene-2-carboxamide CAS Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophenecarboxamide IUPAC Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]thiophene-2-carboxamide Traditional Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]thiophene-2-carboxamide Formula: C21H20ClN3O4S2 MolecularWeight: 477.9842

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(N1C3=CC=C(S3)C(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N)C=C(C=C2)Cl

Isomeric SMILES

C1COC2=C(N1C3=CC=C(S3)C(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N)C=C(C=C2)Cl

InChI

InChI=1S/C21H20ClN3O4S2/c22-15-3-6-18-17(13-15)25(11-12-29-18)20-8-7-19(30-20)21(26)24-10-9-14-1-4-16(5-2-14)31(23,27)28/h1-8,13H,9-12H2,(H,24,26)(H2,23,27,28)