3-(1,3-benzothiazol-2-ylamino)benzenecarbonitrile

Systemtic Name: 3-(1,3-benzothiazol-2-ylamino)benzenecarbonitrile Openeye Name: 3-(1,3-benzothiazol-2-ylamino)benzonitrile CAS Name: 3-(1,3-benzothiazol-2-ylamino)benzonitrile IUPAC Name: 3-(1,3-benzothiazol-2-ylamino)benzonitrile Traditional Name: 3-(1,3-benzothiazol-2-ylamino)benzonitrile Formula: C14H9N3S MolecularWeight: 251.30636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C14H9N3S/c15-9-10-4-3-5-11(8-10)16-14-17-12-6-1-2-7-13(12)18-14/h1-8H,(H,16,17)