2-(1-phenethylbenzimidazol-2-yl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 2-(1-phenethylbenzimidazol-2-yl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 2-(1-phenethylbenzimidazol-2-yl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one CAS Name: 2-[(1-phenethyl-2-benzimidazolyl)thio]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 2-(1-phenethylbenzimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 2-[(1-phenethylbenzimidazol-2-yl)thio]-1-pyrrolidino-propan-1-one Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)SC2=NC3=CC=CC=C3N2CCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCCC1)SC2=NC3=CC=CC=C3N2CCC4=CC=CC=C4

InChI

InChI=1S/C22H25N3OS/c1-17(21(26)24-14-7-8-15-24)27-22-23-19-11-5-6-12-20(19)25(22)16-13-18-9-3-2-4-10-18/h2-6,9-12,17H,7-8,13-16H2,1H3