2-(3-azido-1-phenyl-propyl)sulfanyl-4-chloranyl-benzenecarbonitrile

Systemtic Name: 2-(3-azido-1-phenyl-propyl)sulfanyl-4-chloranyl-benzenecarbonitrile Openeye Name: 2-(3-azido-1-phenyl-propyl)sulfanyl-4-chloro-benzonitrile CAS Name: 2-[(3-azido-1-phenylpropyl)thio]-4-chlorobenzonitrile IUPAC Name: 2-(3-azido-1-phenylpropyl)sulfanyl-4-chlorobenzonitrile Traditional Name: 2-[(3-azido-1-phenyl-propyl)thio]-4-chloro-benzonitrile Formula: C16H13ClN4S MolecularWeight: 328.81922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCN=[N+]=[N-])SC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CCN=[N+]=[N-])SC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C16H13ClN4S/c17-14-7-6-13(11-18)16(10-14)22-15(8-9-20-21-19)12-4-2-1-3-5-12/h1-7,10,15H,8-9H2