4-azanyl-6,7-dimethyl-1,3-bis(oxidanylidene)-2-(2-piperazin-1-ylethyl)isoindole-5-carbonitrile

Systemtic Name: 4-azanyl-6,7-dimethyl-1,3-bis(oxidanylidene)-2-(2-piperazin-1-ylethyl)isoindole-5-carbonitrile Openeye Name: 4-amino-6,7-dimethyl-1,3-dioxo-2-(2-piperazin-1-ylethyl)isoindoline-5-carbonitrile CAS Name: 4-amino-6,7-dimethyl-1,3-dioxo-2-[2-(1-piperazinyl)ethyl]-5-isoindolecarbonitrile IUPAC Name: 4-amino-6,7-dimethyl-1,3-dioxo-2-(2-piperazin-1-ylethyl)isoindole-5-carbonitrile Traditional Name: 4-amino-1,3-diketo-6,7-dimethyl-2-(2-piperazinoethyl)isoindoline-5-carbonitrile Formula: C17H21N5O2 MolecularWeight: 327.38094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C1C)C(=O)N(C2=O)CCN3CCNCC3)N)C#N

Isomeric SMILES

CC1=C(C(=C2C(=C1C)C(=O)N(C2=O)CCN3CCNCC3)N)C#N

InChI

InChI=1S/C17H21N5O2/c1-10-11(2)13-14(15(19)12(10)9-18)17(24)22(16(13)23)8-7-21-5-3-20-4-6-21/h20H,3-8,19H2,1-2H3