methyl 2-[(6-azanyl-1H-benzimidazol-2-yl)methylsulfonyl]ethanoate

Systemtic Name: methyl 2-[(6-azanyl-1H-benzimidazol-2-yl)methylsulfonyl]ethanoate Openeye Name: methyl 2-[(6-amino-1H-benzimidazol-2-yl)methylsulfonyl]acetate CAS Name: 2-[(6-amino-1H-benzimidazol-2-yl)methylsulfonyl]acetic acid methyl ester IUPAC Name: methyl 2-[(6-amino-1H-benzimidazol-2-yl)methylsulfonyl]acetate Traditional Name: 2-[(6-amino-1H-benzimidazol-2-yl)methylsulfonyl]acetic acid methyl ester Formula: C11H13N3O4S MolecularWeight: 283.30362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CS(=O)(=O)CC1=NC2=C(N1)C=C(C=C2)N

Isomeric SMILES

COC(=O)CS(=O)(=O)CC1=NC2=C(N1)C=C(C=C2)N

InChI

InChI=1S/C11H13N3O4S/c1-18-11(15)6-19(16,17)5-10-13-8-3-2-7(12)4-9(8)14-10/h2-4H,5-6,12H2,1H3,(H,13,14)