(E)-3-[1-(phenylmethyl)pyrazol-4-yl]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[1-(phenylmethyl)pyrazol-4-yl]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(1-benzylpyrazol-4-yl)-2-(4-phenylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-[1-(phenylmethyl)-4-pyrazolyl]-2-(4-phenyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(1-benzylpyrazol-4-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)-2-(4-phenylthiazol-2-yl)acrylonitrile Formula: C22H16N4S MolecularWeight: 368.45424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C=C(C#N)C3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)/C=C(\C#N)/C3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H16N4S/c23-12-20(22-25-21(16-27-22)19-9-5-2-6-10-19)11-18-13-24-26(15-18)14-17-7-3-1-4-8-17/h1-11,13,15-16H,14H2/b20-11+