2-[azanyl-(4-cyanophenyl)-(3-methylimidazol-4-yl)methyl]-4-pyridin-3-yl-1-benzothiophene-6-carbonitrile

Systemtic Name: 2-[azanyl-(4-cyanophenyl)-(3-methylimidazol-4-yl)methyl]-4-pyridin-3-yl-1-benzothiophene-6-carbonitrile Openeye Name: 2-[amino-(4-cyanophenyl)-(3-methylimidazol-4-yl)methyl]-4-(3-pyridyl)benzothiophene-6-carbonitrile CAS Name: 2-[amino-(4-cyanophenyl)-(3-methyl-4-imidazolyl)methyl]-4-(3-pyridinyl)-1-benzothiophene-6-carbonitrile IUPAC Name: 2-[amino-(4-cyanophenyl)-(3-methylimidazol-4-yl)methyl]-4-pyridin-3-yl-1-benzothiophene-6-carbonitrile Traditional Name: 2-[amino-(4-cyanophenyl)-(3-methylimidazol-4-yl)methyl]-4-(3-pyridyl)benzothiophene-6-carbonitrile Formula: C26H18N6S MolecularWeight: 446.52632

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)(C3=CC4=C(C=C(C=C4S3)C#N)C5=CN=CC=C5)N

Isomeric SMILES

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)(C3=CC4=C(C=C(C=C4S3)C#N)C5=CN=CC=C5)N

InChI

InChI=1S/C26H18N6S/c1-32-16-31-15-24(32)26(29,20-6-4-17(12-27)5-7-20)25-11-22-21(19-3-2-8-30-14-19)9-18(13-28)10-23(22)33-25/h2-11,14-16H,29H2,1H3