2-tert-butylsulfanyl-4-fluoranyl-5-[4-(2-fluoranylethyl)-2-methyl-piperazin-1-yl]-1H-benzimidazole

Systemtic Name: 2-tert-butylsulfanyl-4-fluoranyl-5-[4-(2-fluoranylethyl)-2-methyl-piperazin-1-yl]-1H-benzimidazole Openeye Name: 2-tert-butylsulfanyl-4-fluoro-5-[4-(2-fluoroethyl)-2-methyl-piperazin-1-yl]-1H-benzimidazole CAS Name: 2-(tert-butylthio)-4-fluoro-5-[4-(2-fluoroethyl)-2-methyl-1-piperazinyl]-1H-benzimidazole IUPAC Name: 2-tert-butylsulfanyl-4-fluoro-5-[4-(2-fluoroethyl)-2-methylpiperazin-1-yl]-1H-benzimidazole Traditional Name: 2-(tert-butylthio)-4-fluoro-5-[4-(2-fluoroethyl)-2-methyl-piperazino]-1H-benzimidazole Formula: C18H26F2N4S MolecularWeight: 368.487646

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=C(C3=C(C=C2)NC(=N3)SC(C)(C)C)F)CCF

Isomeric SMILES

CC1CN(CCN1C2=C(C3=C(C=C2)NC(=N3)SC(C)(C)C)F)CCF

InChI

InChI=1S/C18H26F2N4S/c1-12-11-23(8-7-19)9-10-24(12)14-6-5-13-16(15(14)20)22-17(21-13)25-18(2,3)4/h5-6,12H,7-11H2,1-4H3,(H,21,22)