6-(3-methylpiperazin-1-yl)-2-pentan-3-ylsulfanyl-1H-benzimidazole

Systemtic Name: 6-(3-methylpiperazin-1-yl)-2-pentan-3-ylsulfanyl-1H-benzimidazole Openeye Name: 2-(1-ethylpropylsulfanyl)-6-(3-methylpiperazin-1-yl)-1H-benzimidazole CAS Name: 6-(3-methyl-1-piperazinyl)-2-(pentan-3-ylthio)-1H-benzimidazole IUPAC Name: 6-(3-methylpiperazin-1-yl)-2-pentan-3-ylsulfanyl-1H-benzimidazole Traditional Name: 2-(1-ethylpropylthio)-6-(3-methylpiperazino)-1H-benzimidazole Formula: C17H26N4S MolecularWeight: 318.48014

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)SC1=NC2=C(N1)C=C(C=C2)N3CCNC(C3)C

Isomeric SMILES

CCC(CC)SC1=NC2=C(N1)C=C(C=C2)N3CCNC(C3)C

InChI

InChI=1S/C17H26N4S/c1-4-14(5-2)22-17-19-15-7-6-13(10-16(15)20-17)21-9-8-18-12(3)11-21/h6-7,10,12,14,18H,4-5,8-9,11H2,1-3H3,(H,19,20)