(2-azanyl-5-methylsulfanyl-1,3-benzothiazol-6-yl) thiocyanate

Systemtic Name: (2-azanyl-5-methylsulfanyl-1,3-benzothiazol-6-yl) thiocyanate Openeye Name: (2-amino-5-methylsulfanyl-1,3-benzothiazol-6-yl) thiocyanate CAS Name: thiocyanic acid [2-amino-5-(methylthio)-1,3-benzothiazol-6-yl] ester IUPAC Name: (2-amino-5-methylsulfanyl-1,3-benzothiazol-6-yl) thiocyanate Traditional Name: thiocyanic acid [2-amino-5-(methylthio)-1,3-benzothiazol-6-yl] ester Formula: C9H7N3S3 MolecularWeight: 253.36698

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C2C(=C1)N=C(S2)N)SC#N

Isomeric SMILES

CSC1=C(C=C2C(=C1)N=C(S2)N)SC#N

InChI

InChI=1S/C9H7N3S3/c1-13-7-2-5-6(15-9(11)12-5)3-8(7)14-4-10/h2-3H,1H3,(H2,11,12)