3-[(4-pyridin-2-ylsulfanylphenyl)amino]-2-(2H-1,2,3,4-tetrazol-5-yl)prop-2-enenitrile

Systemtic Name: 3-[(4-pyridin-2-ylsulfanylphenyl)amino]-2-(2H-1,2,3,4-tetrazol-5-yl)prop-2-enenitrile Openeye Name: 3-[4-(2-pyridylsulfanyl)anilino]-2-(2H-tetrazol-5-yl)prop-2-enenitrile CAS Name: 3-[4-(2-pyridinylthio)anilino]-2-(2H-tetrazol-5-yl)-2-propenenitrile IUPAC Name: 3-(4-pyridin-2-ylsulfanylanilino)-2-(2H-tetrazol-5-yl)prop-2-enenitrile Traditional Name: 3-[4-(2-pyridylthio)anilino]-2-(2H-tetrazol-5-yl)acrylonitrile Formula: C15H11N7S MolecularWeight: 321.35974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SC2=CC=C(C=C2)NC=C(C#N)C3=NNN=N3

Isomeric SMILES

C1=CC=NC(=C1)SC2=CC=C(C=C2)NC=C(C#N)C3=NNN=N3

InChI

InChI=1S/C15H11N7S/c16-9-11(15-19-21-22-20-15)10-18-12-4-6-13(7-5-12)23-14-3-1-2-8-17-14/h1-8,10,18H,(H,19,20,21,22)