N-(2-methylquinolin-6-yl)-N-methylsulfonyl-3-(thiophen-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-(2-methylquinolin-6-yl)-N-methylsulfonyl-3-(thiophen-2-ylsulfanylmethyl)benzamide Openeye Name: N-(2-methyl-6-quinolyl)-N-methylsulfonyl-3-(2-thienylsulfanylmethyl)benzamide CAS Name: N-(2-methyl-6-quinolinyl)-N-methylsulfonyl-3-[(thiophen-2-ylthio)methyl]benzamide IUPAC Name: N-(2-methylquinolin-6-yl)-N-methylsulfonyl-3-(thiophen-2-ylsulfanylmethyl)benzamide Traditional Name: N-mesyl-N-(2-methyl-6-quinolyl)-3-[(2-thienylthio)methyl]benzamide Formula: C23H20N2O3S3 MolecularWeight: 468.6115

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)N(C(=O)C3=CC(=CC=C3)CSC4=CC=CS4)S(=O)(=O)C

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)N(C(=O)C3=CC(=CC=C3)CSC4=CC=CS4)S(=O)(=O)C

InChI

InChI=1S/C23H20N2O3S3/c1-16-8-9-18-14-20(10-11-21(18)24-16)25(31(2,27)28)23(26)19-6-3-5-17(13-19)15-30-22-7-4-12-29-22/h3-14H,15H2,1-2H3