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

Systemtic Name: 3-(1,3-benzothiazol-2-ylamino)propanenitrile Openeye Name: 3-(1,3-benzothiazol-2-ylamino)propanenitrile CAS Name: 3-(1,3-benzothiazol-2-ylamino)propanenitrile IUPAC Name: 3-(1,3-benzothiazol-2-ylamino)propanenitrile Traditional Name: 3-(1,3-benzothiazol-2-ylamino)propionitrile Formula: C10H9N3S MolecularWeight: 203.26356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NCCC#N

InChI

InChI=1S/C10H9N3S/c11-6-3-7-12-10-13-8-4-1-2-5-9(8)14-10/h1-2,4-5H,3,7H2,(H,12,13)