4-[4-(4-ethyl-3-oxidanylidene-quinoxalin-2-yl)piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-(4-ethyl-3-oxidanylidene-quinoxalin-2-yl)piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-(4-ethyl-3-oxo-quinoxalin-2-yl)piperazine-1-carbonyl]benzonitrile CAS Name: 4-[[4-(4-ethyl-3-oxo-2-quinoxalinyl)-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-(4-ethyl-3-oxoquinoxalin-2-yl)piperazine-1-carbonyl]benzonitrile Traditional Name: 4-[4-(4-ethyl-3-keto-quinoxalin-2-yl)piperazine-1-carbonyl]benzonitrile Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C(C1=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCN1C2=CC=CC=C2N=C(C1=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H21N5O2/c1-2-27-19-6-4-3-5-18(19)24-20(22(27)29)25-11-13-26(14-12-25)21(28)17-9-7-16(15-23)8-10-17/h3-10H,2,11-14H2,1H3