(E)-2-(1,3-benzothiazol-2-yl)-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(1,3-benzothiazol-2-yl)-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]prop-2-enenitrile CAS Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)-2-propenenitrile IUPAC Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(1,3-benzothiazol-2-yl)-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]acrylonitrile Formula: C24H15N5S MolecularWeight: 405.4744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=NC=C3)C=C(C#N)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=NC=C3)/C=C(\C#N)/C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H15N5S/c25-15-18(24-27-21-8-4-5-9-22(21)30-24)14-19-16-29(20-6-2-1-3-7-20)28-23(19)17-10-12-26-13-11-17/h1-14,16H/b18-14+