N-[(4-butan-2-ylphenyl)-thiophen-2-yl-methyl]-3-(methylsulfonylmethyl)benzamide

Systemtic Name: N-[(4-butan-2-ylphenyl)-thiophen-2-yl-methyl]-3-(methylsulfonylmethyl)benzamide Openeye Name: 3-(methylsulfonylmethyl)-N-[(4-sec-butylphenyl)-(2-thienyl)methyl]benzamide CAS Name: N-[(4-butan-2-ylphenyl)-thiophen-2-ylmethyl]-3-(methylsulfonylmethyl)benzamide IUPAC Name: N-[(4-butan-2-ylphenyl)-thiophen-2-ylmethyl]-3-(methylsulfonylmethyl)benzamide Traditional Name: 3-(mesylmethyl)-N-[(4-sec-butylphenyl)-(2-thienyl)methyl]benzamide Formula: C24H27NO3S2 MolecularWeight: 441.60608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=CC(=CC=C3)CS(=O)(=O)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=CC(=CC=C3)CS(=O)(=O)C

InChI

InChI=1S/C24H27NO3S2/c1-4-17(2)19-10-12-20(13-11-19)23(22-9-6-14-29-22)25-24(26)21-8-5-7-18(15-21)16-30(3,27)28/h5-15,17,23H,4,16H2,1-3H3,(H,25,26)