2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one Openeye Name: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one CAS Name: 2-[(6-chloro-1H-benzimidazol-2-yl)thio]-1-(4-ethyl-1-piperazinyl)-1-propanone IUPAC Name: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one Traditional Name: 2-[(6-chloro-1H-benzimidazol-2-yl)thio]-1-(4-ethylpiperazino)propan-1-one Formula: C16H21ClN4OS MolecularWeight: 352.88214

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)SC2=NC3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CCN1CCN(CC1)C(=O)C(C)SC2=NC3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C16H21ClN4OS/c1-3-20-6-8-21(9-7-20)15(22)11(2)23-16-18-13-5-4-12(17)10-14(13)19-16/h4-5,10-11H,3,6-9H2,1-2H3,(H,18,19)