3-azanyl-4-[2,6-bis(chloranyl)phenyl]sulfanyl-benzenecarbonitrile

Systemtic Name: 3-azanyl-4-[2,6-bis(chloranyl)phenyl]sulfanyl-benzenecarbonitrile Openeye Name: 3-amino-4-(2,6-dichlorophenyl)sulfanyl-benzonitrile CAS Name: 3-amino-4-[(2,6-dichlorophenyl)thio]benzonitrile IUPAC Name: 3-amino-4-(2,6-dichlorophenyl)sulfanylbenzonitrile Traditional Name: 3-amino-4-[(2,6-dichlorophenyl)thio]benzonitrile Formula: C13H8Cl2N2S MolecularWeight: 295.18702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)SC2=C(C=C(C=C2)C#N)N)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)SC2=C(C=C(C=C2)C#N)N)Cl

InChI

InChI=1S/C13H8Cl2N2S/c14-9-2-1-3-10(15)13(9)18-12-5-4-8(7-16)6-11(12)17/h1-6H,17H2