4-[azanyl-(4,6-dipyridin-3-yl-1-benzothiophen-2-yl)-(3-methylimidazol-4-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[azanyl-(4,6-dipyridin-3-yl-1-benzothiophen-2-yl)-(3-methylimidazol-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[amino-[4,6-bis(3-pyridyl)benzothiophen-2-yl]-(3-methylimidazol-4-yl)methyl]benzonitrile CAS Name: 4-[amino-[4,6-bis(3-pyridinyl)-1-benzothiophen-2-yl]-(3-methyl-4-imidazolyl)methyl]benzonitrile IUPAC Name: 4-[amino-(4,6-dipyridin-3-yl-1-benzothiophen-2-yl)-(3-methylimidazol-4-yl)methyl]benzonitrile Traditional Name: 4-[amino-[4,6-bis(3-pyridyl)benzothiophen-2-yl]-(3-methylimidazol-4-yl)methyl]benzonitrile Formula: C30H22N6S MolecularWeight: 498.60088

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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)C5=CN=CC=C5)C6=CN=CC=C6)N

Isomeric SMILES

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)(C3=CC4=C(C=C(C=C4S3)C5=CN=CC=C5)C6=CN=CC=C6)N

InChI

InChI=1S/C30H22N6S/c1-36-19-35-18-28(36)30(32,24-8-6-20(15-31)7-9-24)29-14-26-25(22-5-3-11-34-17-22)12-23(13-27(26)37-29)21-4-2-10-33-16-21/h2-14,16-19H,32H2,1H3