5-(2-aminophenyl)-2-ethylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 5-(2-aminophenyl)-2-ethylsulfanyl-pyridine-3-carbonitrile Openeye Name: 5-(2-aminophenyl)-2-ethylsulfanyl-pyridine-3-carbonitrile CAS Name: 5-(2-aminophenyl)-2-(ethylthio)-3-pyridinecarbonitrile IUPAC Name: 5-(2-aminophenyl)-2-ethylsulfanylpyridine-3-carbonitrile Traditional Name: 5-(2-aminophenyl)-2-(ethylthio)nicotinonitrile Formula: C14H13N3S MolecularWeight: 255.33812

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C=C1C#N)C2=CC=CC=C2N

Isomeric SMILES

CCSC1=NC=C(C=C1C#N)C2=CC=CC=C2N

InChI

InChI=1S/C14H13N3S/c1-2-18-14-10(8-15)7-11(9-17-14)12-5-3-4-6-13(12)16/h3-7,9H,2,16H2,1H3