N-[4-bromanyl-3-methyl-1-(phenylcarbonyl)-7-phenylmethoxy-indol-5-yl]-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-3-methyl-1-(phenylcarbonyl)-7-phenylmethoxy-indol-5-yl]-N-prop-2-ynyl-benzenesulfonamide Openeye Name: N-(1-benzoyl-7-benzyloxy-4-bromo-3-methyl-indol-5-yl)-N-prop-2-ynyl-benzenesulfonamide CAS Name: N-(1-benzoyl-4-bromo-3-methyl-7-phenylmethoxy-5-indolyl)-N-prop-2-ynylbenzenesulfonamide IUPAC Name: N-(1-benzoyl-4-bromo-3-methyl-7-phenylmethoxyindol-5-yl)-N-prop-2-ynylbenzenesulfonamide Traditional Name: N-(7-benzoxy-1-benzoyl-4-bromo-3-methyl-indol-5-yl)-N-propargyl-benzenesulfonamide Formula: C32H25BrN2O4S MolecularWeight: 613.5209

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=C(C=C(C(=C12)Br)N(CC#C)S(=O)(=O)C3=CC=CC=C3)OCC4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CN(C2=C(C=C(C(=C12)Br)N(CC#C)S(=O)(=O)C3=CC=CC=C3)OCC4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C32H25BrN2O4S/c1-3-19-35(40(37,38)26-17-11-6-12-18-26)27-20-28(39-22-24-13-7-4-8-14-24)31-29(30(27)33)23(2)21-34(31)32(36)25-15-9-5-10-16-25/h1,4-18,20-21H,19,22H2,2H3