cyclopropylmethylimino-[[4-(1H-imidazol-2-yl)phenyl]amino]methanesulfonic acid

Systemtic Name: cyclopropylmethylimino-[[4-(1H-imidazol-2-yl)phenyl]amino]methanesulfonic acid Openeye Name: cyclopropylmethylimino-[4-(1H-imidazol-2-yl)anilino]methanesulfonic acid CAS Name: cyclopropylmethylimino-[4-(1H-imidazol-2-yl)anilino]methanesulfonic acid IUPAC Name: cyclopropylmethylimino-[4-(1H-imidazol-2-yl)anilino]methanesulfonic acid Traditional Name: cyclopropylmethylimino-[4-(1H-imidazol-2-yl)anilino]methanesulfonic acid Formula: C14H16N4O3S MolecularWeight: 320.36684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN=C(NC2=CC=C(C=C2)C3=NC=CN3)S(=O)(=O)O

Isomeric SMILES

C1CC1CN=C(NC2=CC=C(C=C2)C3=NC=CN3)S(=O)(=O)O

InChI

InChI=1S/C14H16N4O3S/c19-22(20,21)14(17-9-10-1-2-10)18-12-5-3-11(4-6-12)13-15-7-8-16-13/h3-8,10H,1-2,9H2,(H,15,16)(H,17,18)(H,19,20,21)