2-(4-methylphenyl)sulfanyl-N-[(E)-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethylideneamino]ethanamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-[(E)-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethylideneamino]ethanamide Openeye Name: 2-(p-tolylsulfanyl)-N-[(E)-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethylideneamino]acetamide CAS Name: 2-[(4-methylphenyl)thio]-N-[(E)-1-[4-(1-pyrrolidinylsulfonyl)phenyl]ethylideneamino]acetamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-[(E)-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethylideneamino]acetamide Traditional Name: 2-(p-tolylthio)-N-[(E)-1-(4-pyrrolidinosulfonylphenyl)ethylideneamino]acetamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NN=C(C)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N/N=C(\C)/C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H25N3O3S2/c1-16-5-9-19(10-6-16)28-15-21(25)23-22-17(2)18-7-11-20(12-8-18)29(26,27)24-13-3-4-14-24/h5-12H,3-4,13-15H2,1-2H3,(H,23,25)/b22-17+