(5-diazanyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-2-yl)methanesulfonate

Systemtic Name: (5-diazanyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-2-yl)methanesulfonate Openeye Name: (5-hydrazino-7-phenyl-2,3-dihydro-1H-1,4-diazepin-2-yl)methanesulfonate CAS Name: (5-hydrazinyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-2-yl)methanesulfonate IUPAC Name: (5-hydrazinyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-2-yl)methanesulfonate Traditional Name: (5-hydrazino-7-phenyl-2,3-dihydro-1H-1,4-diazepin-2-yl)methanesulfonate Formula: C12H15N4O3S- MolecularWeight: 295.3375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=CC(=N1)NN)C2=CC=CC=C2)CS(=O)(=O)[O-]

Isomeric SMILES

C1C(NC(=CC(=N1)NN)C2=CC=CC=C2)CS(=O)(=O)[O-]

InChI

InChI=1S/C12H16N4O3S/c13-16-12-6-11(9-4-2-1-3-5-9)15-10(7-14-12)8-20(17,18)19/h1-6,10,15H,7-8,13H2,(H,14,16)(H,17,18,19)/p-1