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

Systemtic Name: 3-[4-[4-[4-(1-azanyl-2-phenyl-ethyl)-1,3-thiazol-2-yl]piperazin-1-yl]butyl]-1H-indole-5-carbonitrile Openeye Name: 3-[4-[4-[4-(1-amino-2-phenyl-ethyl)thiazol-2-yl]piperazin-1-yl]butyl]-1H-indole-5-carbonitrile CAS Name: 3-[4-[4-[4-(1-amino-2-phenylethyl)-2-thiazolyl]-1-piperazinyl]butyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[4-[4-[4-(1-amino-2-phenylethyl)-1,3-thiazol-2-yl]piperazin-1-yl]butyl]-1H-indole-5-carbonitrile Traditional Name: 3-[4-[4-[4-(1-amino-2-phenyl-ethyl)thiazol-2-yl]piperazino]butyl]-1H-indole-5-carbonitrile Formula: C28H32N6S MolecularWeight: 484.65888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C#N)C4=NC(=CS4)C(CC5=CC=CC=C5)N

Isomeric SMILES

C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C#N)C4=NC(=CS4)C(CC5=CC=CC=C5)N

InChI

InChI=1S/C28H32N6S/c29-18-22-9-10-26-24(16-22)23(19-31-26)8-4-5-11-33-12-14-34(15-13-33)28-32-27(20-35-28)25(30)17-21-6-2-1-3-7-21/h1-3,6-7,9-10,16,19-20,25,31H,4-5,8,11-15,17,30H2