ethyl (E)-3-[(2-tert-butyl-3H-benzimidazol-5-yl)amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[(2-tert-butyl-3H-benzimidazol-5-yl)amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[(2-tert-butyl-3H-benzimidazol-5-yl)amino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[(2-tert-butyl-3H-benzimidazol-5-yl)amino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(2-tert-butyl-3H-benzimidazol-5-yl)amino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[(2-tert-butyl-3H-benzimidazol-5-yl)amino]-2-cyano-acrylic acid ethyl ester Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC2=C(C=C1)N=C(N2)C(C)(C)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC2=C(C=C1)N=C(N2)C(C)(C)C)/C#N

InChI

InChI=1S/C17H20N4O2/c1-5-23-15(22)11(9-18)10-19-12-6-7-13-14(8-12)21-16(20-13)17(2,3)4/h6-8,10,19H,5H2,1-4H3,(H,20,21)/b11-10+