2-[4-(imidazol-1-ylmethyl)phenyl]benzenecarbothioamide

Systemtic Name: 2-[4-(imidazol-1-ylmethyl)phenyl]benzenecarbothioamide Openeye Name: 2-[4-(imidazol-1-ylmethyl)phenyl]benzenecarbothioamide CAS Name: 2-[4-(1-imidazolylmethyl)phenyl]benzenecarbothioamide IUPAC Name: 2-[4-(imidazol-1-ylmethyl)phenyl]benzenecarbothioamide Traditional Name: 2-[4-(imidazol-1-ylmethyl)phenyl]thiobenzamide Formula: C17H15N3S MolecularWeight: 293.3861

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)CN3C=CN=C3)C(=S)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)CN3C=CN=C3)C(=S)N

InChI

InChI=1S/C17H15N3S/c18-17(21)16-4-2-1-3-15(16)14-7-5-13(6-8-14)11-20-10-9-19-12-20/h1-10,12H,11H2,(H2,18,21)