(E)-2-(1H-benzimidazol-2-yl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]acrylonitrile Formula: C24H17N5S MolecularWeight: 407.49028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C=C(C#N)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)/C=C(\C#N)/C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C24H17N5S/c25-14-18(24-26-20-9-4-5-10-21(20)27-24)13-19-16-29(15-17-7-2-1-3-8-17)28-23(19)22-11-6-12-30-22/h1-13,16H,15H2,(H,26,27)/b18-13+