3-(methylsulfonylmethyl)-N-prop-2-ynyl-benzamide

Systemtic Name: 3-(methylsulfonylmethyl)-N-prop-2-ynyl-benzamide Openeye Name: 3-(methylsulfonylmethyl)-N-prop-2-ynyl-benzamide CAS Name: 3-(methylsulfonylmethyl)-N-prop-2-ynylbenzamide IUPAC Name: 3-(methylsulfonylmethyl)-N-prop-2-ynylbenzamide Traditional Name: 3-(mesylmethyl)-N-propargyl-benzamide Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)NCC#C

Isomeric SMILES

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)NCC#C

InChI

InChI=1S/C12H13NO3S/c1-3-7-13-12(14)11-6-4-5-10(8-11)9-17(2,15)16/h1,4-6,8H,7,9H2,2H3,(H,13,14)