6-methoxy-2-[(6-pyrrolidin-1-ylpyrimidin-4-yl)methylsulfinyl]-1H-benzimidazole

Systemtic Name: 6-methoxy-2-[(6-pyrrolidin-1-ylpyrimidin-4-yl)methylsulfinyl]-1H-benzimidazole Openeye Name: 6-methoxy-2-[(6-pyrrolidin-1-ylpyrimidin-4-yl)methylsulfinyl]-1H-benzimidazole CAS Name: 6-methoxy-2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]methylsulfinyl]-1H-benzimidazole IUPAC Name: 6-methoxy-2-[(6-pyrrolidin-1-ylpyrimidin-4-yl)methylsulfinyl]-1H-benzimidazole Traditional Name: 6-methoxy-2-[(6-pyrrolidinopyrimidin-4-yl)methylsulfinyl]-1H-benzimidazole Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)S(=O)CC3=CC(=NC=N3)N4CCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)S(=O)CC3=CC(=NC=N3)N4CCCC4

InChI

InChI=1S/C17H19N5O2S/c1-24-13-4-5-14-15(9-13)21-17(20-14)25(23)10-12-8-16(19-11-18-12)22-6-2-3-7-22/h4-5,8-9,11H,2-3,6-7,10H2,1H3,(H,20,21)