2-[(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]benzenecarbonitrile

Systemtic Name: 2-[(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]benzenecarbonitrile Openeye Name: 2-[(6-chlorothiochroman-4-yl)amino]benzonitrile CAS Name: 2-[(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]benzonitrile IUPAC Name: 2-[(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)amino]benzonitrile Traditional Name: 2-[(6-chlorothiochroman-4-yl)amino]benzonitrile Formula: C16H13ClN2S MolecularWeight: 300.80582

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NC3=CC=CC=C3C#N)C=C(C=C2)Cl

Isomeric SMILES

C1CSC2=C(C1NC3=CC=CC=C3C#N)C=C(C=C2)Cl

InChI

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