3-(3,4-dihydro-1H-isothiochromen-4-ylamino)benzenecarbonitrile

Systemtic Name: 3-(3,4-dihydro-1H-isothiochromen-4-ylamino)benzenecarbonitrile Openeye Name: 3-(isothiochroman-4-ylamino)benzonitrile CAS Name: 3-(3,4-dihydro-1H-2-benzothiopyran-4-ylamino)benzonitrile IUPAC Name: 3-(3,4-dihydro-1H-isothiochromen-4-ylamino)benzonitrile Traditional Name: 3-(isothiochroman-4-ylamino)benzonitrile Formula: C16H14N2S MolecularWeight: 266.36076

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2CS1)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1C(C2=CC=CC=C2CS1)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H14N2S/c17-9-12-4-3-6-14(8-12)18-16-11-19-10-13-5-1-2-7-15(13)16/h1-8,16,18H,10-11H2