(2R)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: (2R)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: (2R)-1-(4-benzylpiperazin-1-yl)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-propan-1-one CAS Name: (2R)-2-[(1-ethyl-2-benzimidazolyl)thio]-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: (2R)-1-(4-benzylpiperazin-1-yl)-2-(1-ethylbenzimidazol-2-yl)sulfanylpropan-1-one Traditional Name: (2R)-1-(4-benzylpiperazino)-2-[(1-ethylbenzimidazol-2-yl)thio]propan-1-one Formula: C23H28N4OS MolecularWeight: 408.55962

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1S[C@H](C)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4OS/c1-3-27-21-12-8-7-11-20(21)24-23(27)29-18(2)22(28)26-15-13-25(14-16-26)17-19-9-5-4-6-10-19/h4-12,18H,3,13-17H2,1-2H3/t18-/m1/s1