(2-ethylsulfanyl-4,5-dihydroimidazol-1-yl)-(4-pyrrolidin-1-ylsulfonylphenyl)methanone

Systemtic Name: (2-ethylsulfanyl-4,5-dihydroimidazol-1-yl)-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: (2-ethylsulfanyl-4,5-dihydroimidazol-1-yl)-(4-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: [2-(ethylthio)-4,5-dihydroimidazol-1-yl]-[4-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: (2-ethylsulfanyl-4,5-dihydroimidazol-1-yl)-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: [2-(ethylthio)-2-imidazolin-1-yl]-(4-pyrrolidinosulfonylphenyl)methanone Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NCCN1C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCSC1=NCCN1C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C16H21N3O3S2/c1-2-23-16-17-9-12-19(16)15(20)13-5-7-14(8-6-13)24(21,22)18-10-3-4-11-18/h5-8H,2-4,9-12H2,1H3