3-(4-cyanophenyl)-2-(1,2-thiazol-4-ylmethyl)benzenecarbonitrile

Systemtic Name: 3-(4-cyanophenyl)-2-(1,2-thiazol-4-ylmethyl)benzenecarbonitrile Openeye Name: 3-(4-cyanophenyl)-2-(isothiazol-4-ylmethyl)benzonitrile CAS Name: 3-(4-cyanophenyl)-2-(4-isothiazolylmethyl)benzonitrile IUPAC Name: 3-(4-cyanophenyl)-2-(1,2-thiazol-4-ylmethyl)benzonitrile Traditional Name: 3-(4-cyanophenyl)-2-(isothiazol-4-ylmethyl)benzonitrile Formula: C18H11N3S MolecularWeight: 301.36504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)C2=CC=C(C=C2)C#N)CC3=CSN=C3)C#N

Isomeric SMILES

C1=CC(=C(C(=C1)C2=CC=C(C=C2)C#N)CC3=CSN=C3)C#N

InChI

InChI=1S/C18H11N3S/c19-9-13-4-6-15(7-5-13)17-3-1-2-16(10-20)18(17)8-14-11-21-22-12-14/h1-7,11-12H,8H2