(2R)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: (2R)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: (2R)-1-(4-benzylpiperazin-1-yl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propan-1-one CAS Name: (2R)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: (2R)-1-(4-benzylpiperazin-1-yl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propan-1-one Traditional Name: (2R)-1-(4-benzylpiperazino)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]propan-1-one Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)SC3=NC4=C(N3)C=C(C=C4)OC

Isomeric SMILES

C[C@H](C(=O)N1CCN(CC1)CC2=CC=CC=C2)SC3=NC4=C(N3)C=C(C=C4)OC

InChI

InChI=1S/C22H26N4O2S/c1-16(29-22-23-19-9-8-18(28-2)14-20(19)24-22)21(27)26-12-10-25(11-13-26)15-17-6-4-3-5-7-17/h3-9,14,16H,10-13,15H2,1-2H3,(H,23,24)/t16-/m1/s1