3-[3-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazin-1-yl]propyl]-1H-indole-5-carbonitrile

Systemtic Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazin-1-yl]propyl]-1H-indole-5-carbonitrile Openeye Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazin-1-yl]propyl]-1H-indole-5-carbonitrile CAS Name: 3-[3-[4-(5-methoxy-4-pyrimidinyl)-3-methyl-1-piperazinyl]propyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)-3-methylpiperazin-1-yl]propyl]-1H-indole-5-carbonitrile Traditional Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazino]propyl]-1H-indole-5-carbonitrile Formula: C22H26N6O MolecularWeight: 390.48144

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=NC=NC=C2OC)CCCC3=CNC4=C3C=C(C=C4)C#N

Isomeric SMILES

CC1CN(CCN1C2=NC=NC=C2OC)CCCC3=CNC4=C3C=C(C=C4)C#N

InChI

InChI=1S/C22H26N6O/c1-16-14-27(8-9-28(16)22-21(29-2)13-24-15-26-22)7-3-4-18-12-25-20-6-5-17(11-23)10-19(18)20/h5-6,10,12-13,15-16,25H,3-4,7-9,14H2,1-2H3