2-azanyl-6-[(2-chlorophenyl)methylsulfanyl]-4-thiophen-2-yl-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[(2-chlorophenyl)methylsulfanyl]-4-thiophen-2-yl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-[(2-chlorophenyl)methylsulfanyl]-4-(2-thienyl)pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-[(2-chlorophenyl)methylthio]-4-thiophen-2-ylpyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[(2-chlorophenyl)methylsulfanyl]-4-thiophen-2-ylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-[(2-chlorobenzyl)thio]-4-(2-thienyl)pyridin-1-ium-3,5-dicarbonitrile Formula: C18H12ClN4S2+ MolecularWeight: 383.89768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=C(C(=C(C(=[NH+]2)N)C#N)C3=CC=CS3)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=C(C(=C(C(=[NH+]2)N)C#N)C3=CC=CS3)C#N)Cl

InChI

InChI=1S/C18H11ClN4S2/c19-14-5-2-1-4-11(14)10-25-18-13(9-21)16(15-6-3-7-24-15)12(8-20)17(22)23-18/h1-7H,10H2,(H2,22,23)/p+1