4-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methylsulfanyl]quinazoline

Systemtic Name: 4-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methylsulfanyl]quinazoline Openeye Name: 4-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methylsulfanyl]quinazoline CAS Name: 4-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methylthio]quinazoline IUPAC Name: 4-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methylsulfanyl]quinazoline Traditional Name: 4-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methylthio]quinazoline Formula: C23H25N5O2S2 MolecularWeight: 467.6069

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NC=NC5=CC=CC=C54

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NC=NC5=CC=CC=C54

InChI

InChI=1S/C23H25N5O2S2/c1-2-28-21-11-10-17(32(29,30)27-12-6-3-7-13-27)14-20(21)26-22(28)15-31-23-18-8-4-5-9-19(18)24-16-25-23/h4-5,8-11,14,16H,2-3,6-7,12-13,15H2,1H3