N-(3,4-dimethylphenyl)-2-[4-(thiophen-2-ylsulfonylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(3,4-dimethylphenyl)-2-[4-(thiophen-2-ylsulfonylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(3,4-dimethylphenyl)-2-[4-(2-thienylsulfonylamino)phenyl]sulfanyl-propanamide CAS Name: N-(3,4-dimethylphenyl)-2-[[4-(thiophen-2-ylsulfonylamino)phenyl]thio]propanamide IUPAC Name: N-(3,4-dimethylphenyl)-2-[4-(thiophen-2-ylsulfonylamino)phenyl]sulfanylpropanamide Traditional Name: N-(3,4-dimethylphenyl)-2-[[4-(2-thienylsulfonylamino)phenyl]thio]propionamide Formula: C21H22N2O3S3 MolecularWeight: 446.60598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C21H22N2O3S3/c1-14-6-7-18(13-15(14)2)22-21(24)16(3)28-19-10-8-17(9-11-19)23-29(25,26)20-5-4-12-27-20/h4-13,16,23H,1-3H3,(H,22,24)