N-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-chloranyl-pyridin-4-yl]-N',N'-diethyl-N-methyl-ethane-1,2-diamine

Systemtic Name: N-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-chloranyl-pyridin-4-yl]-N',N'-diethyl-N-methyl-ethane-1,2-diamine Openeye Name: N-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-chloro-4-pyridyl]-N',N'-diethyl-N-methyl-ethane-1,2-diamine CAS Name: N-[2-[(1H-benzimidazol-2-ylthio)methyl]-3-chloro-4-pyridinyl]-N',N'-diethyl-N-methylethane-1,2-diamine IUPAC Name: N-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-chloropyridin-4-yl]-N',N'-diethyl-N-methylethane-1,2-diamine Traditional Name: [2-[(1H-benzimidazol-2-ylthio)methyl]-3-chloro-4-pyridyl]-(2-diethylaminoethyl)-methyl-amine Formula: C20H26ClN5S MolecularWeight: 403.97194

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C)C1=C(C(=NC=C1)CSC2=NC3=CC=CC=C3N2)Cl

Isomeric SMILES

CCN(CC)CCN(C)C1=C(C(=NC=C1)CSC2=NC3=CC=CC=C3N2)Cl

InChI

InChI=1S/C20H26ClN5S/c1-4-26(5-2)13-12-25(3)18-10-11-22-17(19(18)21)14-27-20-23-15-8-6-7-9-16(15)24-20/h6-11H,4-5,12-14H2,1-3H3,(H,23,24)