[3-[(6-azanyl-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]-(2-cyanoethyl)-methyl-azanium

Systemtic Name: [3-[(6-azanyl-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]-(2-cyanoethyl)-methyl-azanium Openeye Name: [3-[(6-amino-1,3-benzothiazol-2-yl)amino]-3-oxo-propyl]-(2-cyanoethyl)-methyl-ammonium CAS Name: [3-[(6-amino-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]-(2-cyanoethyl)-methylammonium IUPAC Name: [3-[(6-amino-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]-(2-cyanoethyl)-methylazanium Traditional Name: [3-[(6-amino-1,3-benzothiazol-2-yl)amino]-3-keto-propyl]-(2-cyanoethyl)-methyl-ammonium Formula: C14H18N5OS+ MolecularWeight: 304.39062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC#N)CCC(=O)NC1=NC2=C(S1)C=C(C=C2)N

Isomeric SMILES

C[NH+](CCC#N)CCC(=O)NC1=NC2=C(S1)C=C(C=C2)N

InChI

InChI=1S/C14H17N5OS/c1-19(7-2-6-15)8-5-13(20)18-14-17-11-4-3-10(16)9-12(11)21-14/h3-4,9H,2,5,7-8,16H2,1H3,(H,17,18,20)/p+1