4,6-bis(azanyl)-2-(naphthalen-1-ylmethylsulfanyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 4,6-bis(azanyl)-2-(naphthalen-1-ylmethylsulfanyl)pyridin-1-ium-3-carbonitrile Openeye Name: 4,6-diamino-2-(1-naphthylmethylsulfanyl)pyridin-1-ium-3-carbonitrile CAS Name: 4,6-diamino-2-(1-naphthalenylmethylthio)-3-pyridin-1-iumcarbonitrile IUPAC Name: 4,6-diamino-2-(naphthalen-1-ylmethylsulfanyl)pyridin-1-ium-3-carbonitrile Traditional Name: 4,6-diamino-2-(1-naphthylmethylthio)pyridin-1-ium-3-carbonitrile Formula: C17H15N4S+ MolecularWeight: 307.3928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSC3=C(C(=CC(=[NH+]3)N)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=C(C(=CC(=[NH+]3)N)N)C#N

InChI

InChI=1S/C17H14N4S/c18-9-14-15(19)8-16(20)21-17(14)22-10-12-6-3-5-11-4-1-2-7-13(11)12/h1-8H,10H2,(H4,19,20,21)/p+1