2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-pyrrolidin-1-yl-propan-1-one CAS Name: 2-[[1-(4-methoxyphenyl)-2-imidazolyl]thio]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 2-[[1-(4-methoxyphenyl)imidazol-2-yl]thio]-1-pyrrolidino-propan-1-one Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)SC2=NC=CN2C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C(=O)N1CCCC1)SC2=NC=CN2C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H21N3O2S/c1-13(16(21)19-10-3-4-11-19)23-17-18-9-12-20(17)14-5-7-15(22-2)8-6-14/h5-9,12-13H,3-4,10-11H2,1-2H3