3-chloranyl-4-(4-propylphenyl)sulfanyl-benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-(4-propylphenyl)sulfanyl-benzenecarbonitrile Openeye Name: 3-chloro-4-(4-propylphenyl)sulfanyl-benzonitrile CAS Name: 3-chloro-4-[(4-propylphenyl)thio]benzonitrile IUPAC Name: 3-chloro-4-(4-propylphenyl)sulfanylbenzonitrile Traditional Name: 3-chloro-4-[(4-propylphenyl)thio]benzonitrile Formula: C16H14ClNS MolecularWeight: 287.80706

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)SC2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)SC2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C16H14ClNS/c1-2-3-12-4-7-14(8-5-12)19-16-9-6-13(11-18)10-15(16)17/h4-10H,2-3H2,1H3