2-pentan-3-ylsulfanyl-6-piperazin-1-yl-3H-benzimidazole-5-carbonitrile

Systemtic Name: 2-pentan-3-ylsulfanyl-6-piperazin-1-yl-3H-benzimidazole-5-carbonitrile Openeye Name: 2-(1-ethylpropylsulfanyl)-6-piperazin-1-yl-3H-benzimidazole-5-carbonitrile CAS Name: 2-(pentan-3-ylthio)-6-(1-piperazinyl)-3H-benzimidazole-5-carbonitrile IUPAC Name: 2-pentan-3-ylsulfanyl-6-piperazin-1-yl-3H-benzimidazole-5-carbonitrile Traditional Name: 2-(1-ethylpropylthio)-6-piperazino-3H-benzimidazole-5-carbonitrile Formula: C17H23N5S MolecularWeight: 329.46302

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)SC1=NC2=C(N1)C=C(C(=C2)N3CCNCC3)C#N

Isomeric SMILES

CCC(CC)SC1=NC2=C(N1)C=C(C(=C2)N3CCNCC3)C#N

InChI

InChI=1S/C17H23N5S/c1-3-13(4-2)23-17-20-14-9-12(11-18)16(10-15(14)21-17)22-7-5-19-6-8-22/h9-10,13,19H,3-8H2,1-2H3,(H,20,21)