3-[3-[(E)-3-oxidanylidene-3-(4-pyrazin-2-ylpiperazin-1-yl)prop-1-enyl]indol-1-yl]propanenitrile

Systemtic Name: 3-[3-[(E)-3-oxidanylidene-3-(4-pyrazin-2-ylpiperazin-1-yl)prop-1-enyl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[(E)-3-oxo-3-(4-pyrazin-2-ylpiperazin-1-yl)prop-1-enyl]indol-1-yl]propanenitrile CAS Name: 3-[3-[(E)-3-oxo-3-[4-(2-pyrazinyl)-1-piperazinyl]prop-1-enyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[(E)-3-oxo-3-(4-pyrazin-2-ylpiperazin-1-yl)prop-1-enyl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[(E)-3-keto-3-(4-pyrazin-2-ylpiperazino)prop-1-enyl]indol-1-yl]propionitrile Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2)C(=O)C=CC3=CN(C4=CC=CC=C43)CCC#N

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)C(=O)/C=C/C3=CN(C4=CC=CC=C43)CCC#N

InChI

InChI=1S/C22H22N6O/c23-8-3-11-28-17-18(19-4-1-2-5-20(19)28)6-7-22(29)27-14-12-26(13-15-27)21-16-24-9-10-25-21/h1-2,4-7,9-10,16-17H,3,11-15H2/b7-6+