3-[4-[4-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]piperazin-1-yl]butyl]-1H-indole-5-carbonitrile

Systemtic Name: 3-[4-[4-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]piperazin-1-yl]butyl]-1H-indole-5-carbonitrile Openeye Name: 3-[4-[4-[4-(1H-indol-3-yl)thiazol-2-yl]piperazin-1-yl]butyl]-1H-indole-5-carbonitrile CAS Name: 3-[4-[4-[4-(1H-indol-3-yl)-2-thiazolyl]-1-piperazinyl]butyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[4-[4-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]piperazin-1-yl]butyl]-1H-indole-5-carbonitrile Traditional Name: 3-[4-[4-[4-(1H-indol-3-yl)thiazol-2-yl]piperazino]butyl]-1H-indole-5-carbonitrile Formula: C28H28N6S MolecularWeight: 480.62712

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C#N)C4=NC(=CS4)C5=CNC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C#N)C4=NC(=CS4)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C28H28N6S/c29-16-20-8-9-26-23(15-20)21(17-30-26)5-3-4-10-33-11-13-34(14-12-33)28-32-27(19-35-28)24-18-31-25-7-2-1-6-22(24)25/h1-2,6-9,15,17-19,30-31H,3-5,10-14H2