2-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]ethanenitrile

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]ethanenitrile Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]acetonitrile CAS Name: 2-[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]acetonitrile IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]acetonitrile Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]acetonitrile Formula: C12H7N3S2 MolecularWeight: 257.33408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CSC(=N3)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CSC(=N3)CC#N

InChI

InChI=1S/C12H7N3S2/c13-6-5-11-14-9(7-16-11)12-15-8-3-1-2-4-10(8)17-12/h1-4,7H,5H2