4-(imidazol-1-ylmethyl)-2-naphthalen-2-ylsulfanyl-benzenecarbonitrile

Systemtic Name: 4-(imidazol-1-ylmethyl)-2-naphthalen-2-ylsulfanyl-benzenecarbonitrile Openeye Name: 4-(imidazol-1-ylmethyl)-2-(2-naphthylsulfanyl)benzonitrile CAS Name: 4-(1-imidazolylmethyl)-2-(2-naphthalenylthio)benzonitrile IUPAC Name: 4-(imidazol-1-ylmethyl)-2-naphthalen-2-ylsulfanylbenzonitrile Traditional Name: 4-(imidazol-1-ylmethyl)-2-(2-naphthylthio)benzonitrile Formula: C21H15N3S MolecularWeight: 341.4289

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)SC3=C(C=CC(=C3)CN4C=CN=C4)C#N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)SC3=C(C=CC(=C3)CN4C=CN=C4)C#N

InChI

InChI=1S/C21H15N3S/c22-13-19-6-5-16(14-24-10-9-23-15-24)11-21(19)25-20-8-7-17-3-1-2-4-18(17)12-20/h1-12,15H,14H2