2-[5-(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]-5-bromanyl-3-pyrrolidin-1-ylsulfonyl-1H-indole

Systemtic Name: 2-[5-(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]-5-bromanyl-3-pyrrolidin-1-ylsulfonyl-1H-indole Openeye Name: 2-[5-(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]-5-bromo-3-pyrrolidin-1-ylsulfonyl-1H-indole CAS Name: 2-[5-(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]-5-bromo-3-(1-pyrrolidinylsulfonyl)-1H-indole IUPAC Name: 2-[5-(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]-5-bromo-3-pyrrolidin-1-ylsulfonyl-1H-indole Traditional Name: 2-[5-(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]-5-bromo-3-pyrrolidinosulfonyl-1H-indole Formula: C22H19BrN4O4S MolecularWeight: 515.37966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)C4=NC=C(N4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)C4=NC=C(N4)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C22H19BrN4O4S/c23-14-4-5-16-15(10-14)21(32(28,29)27-7-1-2-8-27)20(25-16)22-24-11-17(26-22)13-3-6-18-19(9-13)31-12-30-18/h3-6,9-11,25H,1-2,7-8,12H2,(H,24,26)