phenylcarbonylazanium; 1-thia-2-aza-3-azanidacyclopent-4-en-4-amine

Systemtic Name: phenylcarbonylazanium; 1-thia-2-aza-3-azanidacyclopent-4-en-4-amine Openeye Name: benzoylammonium; 1-thia-2-aza-3-azanidacyclopent-4-en-4-amine CAS Name: benzoylammonium; 1-thia-2-aza-3-azanidacyclopent-4-en-4-amine IUPAC Name: benzoylazanium; 1-thia-2-aza-3-azanidacyclopent-4-en-4-amine Traditional Name: benzoylammonium; 1-thia-2-aza-3-azanidacyclopent-4-en-4-ylamine Formula: C9H12N4OS MolecularWeight: 224.28278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)[NH3+].C1=C([N-]NS1)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)[NH3+].C1=C([N-]NS1)N

InChI

InChI=1S/C7H7NO.C2H4N3S/c8-7(9)6-4-2-1-3-5-6;3-2-1-6-5-4-2/h1-5H,(H2,8,9);1,5H,3H2/q;-1/p+1