3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanylpropanenitrile

Systemtic Name: 3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanylpropanenitrile Openeye Name: 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanylpropanenitrile CAS Name: 3-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]propanenitrile IUPAC Name: 3-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylpropanenitrile Traditional Name: 3-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]propionitrile Formula: C16H20N4O3S2 MolecularWeight: 380.485

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCC#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCC#N

InChI

InChI=1S/C16H20N4O3S2/c1-2-20-15-5-4-13(25(21,22)19-7-9-23-10-8-19)12-14(15)18-16(20)24-11-3-6-17/h4-5,12H,2-3,7-11H2,1H3