2-[(5,6-diethoxy-1H-benzimidazol-2-yl)-sulfinyl-methyl]-N,N,4-trimethyl-aniline

Systemtic Name: 2-[(5,6-diethoxy-1H-benzimidazol-2-yl)-sulfinyl-methyl]-N,N,4-trimethyl-aniline Openeye Name: 2-[(5,6-diethoxy-1H-benzimidazol-2-yl)-sulfinyl-methyl]-N,N,4-trimethyl-aniline CAS Name: 2-[(5,6-diethoxy-1H-benzimidazol-2-yl)-sulfinylmethyl]-N,N,4-trimethylaniline IUPAC Name: 2-[(5,6-diethoxy-1H-benzimidazol-2-yl)-sulfinylmethyl]-N,N,4-trimethylaniline Traditional Name: [2-[(5,6-diethoxy-1H-benzimidazol-2-yl)-sulfinyl-methyl]-4-methyl-phenyl]-dimethyl-amine Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)NC(=N2)C(=S=O)C3=C(C=CC(=C3)C)N(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)NC(=N2)C(=S=O)C3=C(C=CC(=C3)C)N(C)C)OCC

InChI

InChI=1S/C21H25N3O3S/c1-6-26-18-11-15-16(12-19(18)27-7-2)23-21(22-15)20(28-25)14-10-13(3)8-9-17(14)24(4)5/h8-12H,6-7H2,1-5H3,(H,22,23)