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

Systemtic Name: 2-chloranyl-4-(3,4-dihydro-1H-isothiochromen-4-ylamino)benzenecarbonitrile Openeye Name: 2-chloro-4-(isothiochroman-4-ylamino)benzonitrile CAS Name: 2-chloro-4-(3,4-dihydro-1H-2-benzothiopyran-4-ylamino)benzonitrile IUPAC Name: 2-chloro-4-(3,4-dihydro-1H-isothiochromen-4-ylamino)benzonitrile Traditional Name: 2-chloro-4-(isothiochroman-4-ylamino)benzonitrile Formula: C16H13ClN2S MolecularWeight: 300.80582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN2S/c17-15-7-13(6-5-11(15)8-18)19-16-10-20-9-12-3-1-2-4-14(12)16/h1-7,16,19H,9-10H2