2-[[4-(2-pentan-3-ylsulfanyl-3H-benzimidazol-5-yl)piperazin-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-[[4-(2-pentan-3-ylsulfanyl-3H-benzimidazol-5-yl)piperazin-1-yl]methyl]-1,3-thiazole Openeye Name: 2-[[4-[2-(1-ethylpropylsulfanyl)-3H-benzimidazol-5-yl]piperazin-1-yl]methyl]thiazole CAS Name: 2-[[4-[2-(pentan-3-ylthio)-3H-benzimidazol-5-yl]-1-piperazinyl]methyl]thiazole IUPAC Name: 2-[[4-(2-pentan-3-ylsulfanyl-3H-benzimidazol-5-yl)piperazin-1-yl]methyl]-1,3-thiazole Traditional Name: 2-[[4-[2-(1-ethylpropylthio)-3H-benzimidazol-5-yl]piperazino]methyl]thiazole Formula: C20H27N5S2 MolecularWeight: 401.59188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)SC1=NC2=C(N1)C=C(C=C2)N3CCN(CC3)CC4=NC=CS4

Isomeric SMILES

CCC(CC)SC1=NC2=C(N1)C=C(C=C2)N3CCN(CC3)CC4=NC=CS4

InChI

InChI=1S/C20H27N5S2/c1-3-16(4-2)27-20-22-17-6-5-15(13-18(17)23-20)25-10-8-24(9-11-25)14-19-21-7-12-26-19/h5-7,12-13,16H,3-4,8-11,14H2,1-2H3,(H,22,23)