4-[2-[4-(2-azanylethanoyl)-3-(1H-indol-6-ylcarbonyl)-3-phenyl-piperazin-1-yl]ethyl]pyridine-2-carbonitrile

Systemtic Name: 4-[2-[4-(2-azanylethanoyl)-3-(1H-indol-6-ylcarbonyl)-3-phenyl-piperazin-1-yl]ethyl]pyridine-2-carbonitrile Openeye Name: 4-[2-[4-(2-aminoacetyl)-3-(1H-indole-6-carbonyl)-3-phenyl-piperazin-1-yl]ethyl]pyridine-2-carbonitrile CAS Name: 4-[2-[4-(2-amino-1-oxoethyl)-3-[1H-indol-6-yl(oxo)methyl]-3-phenyl-1-piperazinyl]ethyl]-2-pyridinecarbonitrile IUPAC Name: 4-[2-[4-(2-aminoacetyl)-3-(1H-indole-6-carbonyl)-3-phenylpiperazin-1-yl]ethyl]pyridine-2-carbonitrile Traditional Name: 4-[2-[4-glycyl-3-(1H-indole-6-carbonyl)-3-phenyl-piperazino]ethyl]picolinonitrile Formula: C29H28N6O2 MolecularWeight: 492.57162

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CCC2=CC(=NC=C2)C#N)(C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)C=CN5)C(=O)CN

Isomeric SMILES

C1CN(C(CN1CCC2=CC(=NC=C2)C#N)(C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)C=CN5)C(=O)CN

InChI

InChI=1S/C29H28N6O2/c30-18-25-16-21(8-11-32-25)10-13-34-14-15-35(27(36)19-31)29(20-34,24-4-2-1-3-5-24)28(37)23-7-6-22-9-12-33-26(22)17-23/h1-9,11-12,16-17,33H,10,13-15,19-20,31H2