(2-azanyl-3H-benzimidazol-5-yl) 4-(cyclopentylamino)benzenesulfonate

Systemtic Name: (2-azanyl-3H-benzimidazol-5-yl) 4-(cyclopentylamino)benzenesulfonate Openeye Name: (2-amino-3H-benzimidazol-5-yl) 4-(cyclopentylamino)benzenesulfonate CAS Name: 4-(cyclopentylamino)benzenesulfonic acid (2-amino-3H-benzimidazol-5-yl) ester IUPAC Name: (2-amino-3H-benzimidazol-5-yl) 4-(cyclopentylamino)benzenesulfonate Traditional Name: 4-(cyclopentylamino)benzenesulfonic acid (2-amino-3H-benzimidazol-5-yl) ester Formula: C18H20N4O3S MolecularWeight: 372.4414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)N

Isomeric SMILES

C1CCC(C1)NC2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)N

InChI

InChI=1S/C18H20N4O3S/c19-18-21-16-10-7-14(11-17(16)22-18)25-26(23,24)15-8-5-13(6-9-15)20-12-3-1-2-4-12/h5-12,20H,1-4H2,(H3,19,21,22)