(2S)-1-[(Z)-2-azanyl-4-(1,3-dihydroisoindol-2-yl)-4-oxidanylidene-but-2-enoyl]pyrrolidine-2-carbonitrile

Systemtic Name: (2S)-1-[(Z)-2-azanyl-4-(1,3-dihydroisoindol-2-yl)-4-oxidanylidene-but-2-enoyl]pyrrolidine-2-carbonitrile Openeye Name: (2S)-1-[(Z)-2-amino-4-isoindolin-2-yl-4-oxo-but-2-enoyl]pyrrolidine-2-carbonitrile CAS Name: (2S)-1-[(Z)-2-amino-4-(1,3-dihydroisoindol-2-yl)-1,4-dioxobut-2-enyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S)-1-[(Z)-2-amino-4-(1,3-dihydroisoindol-2-yl)-4-oxobut-2-enoyl]pyrrolidine-2-carbonitrile Traditional Name: (2S)-1-[(Z)-2-amino-4-isoindolin-2-yl-4-keto-but-2-enoyl]pyrrolidine-2-carbonitrile Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(=CC(=O)N2CC3=CC=CC=C3C2)N)C#N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)/C(=C/C(=O)N2CC3=CC=CC=C3C2)/N)C#N

InChI

InChI=1S/C17H18N4O2/c18-9-14-6-3-7-21(14)17(23)15(19)8-16(22)20-10-12-4-1-2-5-13(12)11-20/h1-2,4-5,8,14H,3,6-7,10-11,19H2/b15-8-/t14-/m0/s1