4-[5-(4-chlorophenyl)sulfanyl-1-methyl-2-pyrazin-2-yl-imidazol-4-yl]benzenecarbonitrile

Systemtic Name: 4-[5-(4-chlorophenyl)sulfanyl-1-methyl-2-pyrazin-2-yl-imidazol-4-yl]benzenecarbonitrile Openeye Name: 4-[5-(4-chlorophenyl)sulfanyl-1-methyl-2-pyrazin-2-yl-imidazol-4-yl]benzonitrile CAS Name: 4-[5-[(4-chlorophenyl)thio]-1-methyl-2-(2-pyrazinyl)-4-imidazolyl]benzonitrile IUPAC Name: 4-[5-(4-chlorophenyl)sulfanyl-1-methyl-2-pyrazin-2-ylimidazol-4-yl]benzonitrile Traditional Name: 4-[5-[(4-chlorophenyl)thio]-1-methyl-2-pyrazin-2-yl-imidazol-4-yl]benzonitrile Formula: C21H14ClN5S MolecularWeight: 403.88736

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1C2=NC=CN=C2)C3=CC=C(C=C3)C#N)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(=C(N=C1C2=NC=CN=C2)C3=CC=C(C=C3)C#N)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14ClN5S/c1-27-20(18-13-24-10-11-25-18)26-19(15-4-2-14(12-23)3-5-15)21(27)28-17-8-6-16(22)7-9-17/h2-11,13H,1H3