N-butyl-2-[3-(phenylmethyl)sulfonylindol-1-yl]ethanamide

Systemtic Name: N-butyl-2-[3-(phenylmethyl)sulfonylindol-1-yl]ethanamide Openeye Name: 2-(3-benzylsulfonylindol-1-yl)-N-butyl-acetamide CAS Name: N-butyl-2-[3-(phenylmethyl)sulfonyl-1-indolyl]acetamide IUPAC Name: 2-(3-benzylsulfonylindol-1-yl)-N-butylacetamide Traditional Name: 2-(3-benzylsulfonylindol-1-yl)-N-butyl-acetamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1C=C(C2=CC=CC=C21)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)CN1C=C(C2=CC=CC=C21)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3S/c1-2-3-13-22-21(24)15-23-14-20(18-11-7-8-12-19(18)23)27(25,26)16-17-9-5-4-6-10-17/h4-12,14H,2-3,13,15-16H2,1H3,(H,22,24)