N-(1,2-benzoxazol-3-yl)-5-bromanyl-1-propanoyl-2,3-dihydroindole-6-sulfonamide

Systemtic Name: N-(1,2-benzoxazol-3-yl)-5-bromanyl-1-propanoyl-2,3-dihydroindole-6-sulfonamide Openeye Name: N-(1,2-benzoxazol-3-yl)-5-bromo-1-propanoyl-indoline-6-sulfonamide CAS Name: N-(1,2-benzoxazol-3-yl)-5-bromo-1-(1-oxopropyl)-2,3-dihydroindole-6-sulfonamide IUPAC Name: N-(1,2-benzoxazol-3-yl)-5-bromo-1-propanoyl-2,3-dihydroindole-6-sulfonamide Traditional Name: 5-bromo-N-indoxazen-3-yl-1-propionyl-indoline-6-sulfonamide Formula: C18H16BrN3O4S MolecularWeight: 450.30634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)NC3=NOC4=CC=CC=C43)Br

Isomeric SMILES

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)NC3=NOC4=CC=CC=C43)Br

InChI

InChI=1S/C18H16BrN3O4S/c1-2-17(23)22-8-7-11-9-13(19)16(10-14(11)22)27(24,25)21-18-12-5-3-4-6-15(12)26-20-18/h3-6,9-10H,2,7-8H2,1H3,(H,20,21)