[2-[(2-methylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [2-[(2-methylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: [2-(o-tolylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: [2-[(2-methylphenyl)methylthio]-4,5-dihydroimidazol-1-yl]-[4-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: [2-[(2-methylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: [2-[(2-methylbenzyl)thio]-2-imidazolin-1-yl]-(4-pyrrolidinosulfonylphenyl)methanone Formula: C22H25N3O3S2 MolecularWeight: 443.5822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NCCN2C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NCCN2C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H25N3O3S2/c1-17-6-2-3-7-19(17)16-29-22-23-12-15-25(22)21(26)18-8-10-20(11-9-18)30(27,28)24-13-4-5-14-24/h2-3,6-11H,4-5,12-16H2,1H3