3-(2-azanylethyl)-4-ethanoyl-5-(1H-indol-5-yloxy)-2-piperazin-1-yl-benzenesulfonamide

Systemtic Name: 3-(2-azanylethyl)-4-ethanoyl-5-(1H-indol-5-yloxy)-2-piperazin-1-yl-benzenesulfonamide Openeye Name: 4-acetyl-3-(2-aminoethyl)-5-(1H-indol-5-yloxy)-2-piperazin-1-yl-benzenesulfonamide CAS Name: 4-acetyl-3-(2-aminoethyl)-5-(1H-indol-5-yloxy)-2-(1-piperazinyl)benzenesulfonamide IUPAC Name: 4-acetyl-3-(2-aminoethyl)-5-(1H-indol-5-yloxy)-2-piperazin-1-ylbenzenesulfonamide Traditional Name: 4-acetyl-3-(2-aminoethyl)-5-(1H-indol-5-yloxy)-2-piperazino-benzenesulfonamide Formula: C22H27N5O4S MolecularWeight: 457.54588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=C(C=C1OC2=CC3=C(C=C2)NC=C3)S(=O)(=O)N)N4CCNCC4)CCN

Isomeric SMILES

CC(=O)C1=C(C(=C(C=C1OC2=CC3=C(C=C2)NC=C3)S(=O)(=O)N)N4CCNCC4)CCN

InChI

InChI=1S/C22H27N5O4S/c1-14(28)21-17(4-6-23)22(27-10-8-25-9-11-27)20(32(24,29)30)13-19(21)31-16-2-3-18-15(12-16)5-7-26-18/h2-3,5,7,12-13,25-26H,4,6,8-11,23H2,1H3,(H2,24,29,30)