2-[(2-methylpropan-2-yl)oxycarbonyl-[(E)-3-phenylprop-2-enyl]amino]ethyl 4-(3-cyanopyrazin-2-yl)piperazine-1-carboxylate

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-[(E)-3-phenylprop-2-enyl]amino]ethyl 4-(3-cyanopyrazin-2-yl)piperazine-1-carboxylate Openeye Name: 2-[tert-butoxycarbonyl-[(E)-cinnamyl]amino]ethyl 4-(3-cyanopyrazin-2-yl)piperazine-1-carboxylate CAS Name: 4-(3-cyano-2-pyrazinyl)-1-piperazinecarboxylic acid 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-[(E)-3-phenylprop-2-enyl]amino]ethyl ester IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-[(E)-3-phenylprop-2-enyl]amino]ethyl 4-(3-cyanopyrazin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(3-cyanopyrazin-2-yl)piperazine-1-carboxylic acid 2-[tert-butoxycarbonyl-[(E)-cinnamyl]amino]ethyl ester Formula: C26H32N6O4 MolecularWeight: 492.57008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCOC(=O)N1CCN(CC1)C2=NC=CN=C2C#N)CC=CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(CCOC(=O)N1CCN(CC1)C2=NC=CN=C2C#N)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C26H32N6O4/c1-26(2,3)36-25(34)31(13-7-10-21-8-5-4-6-9-21)18-19-35-24(33)32-16-14-30(15-17-32)23-22(20-27)28-11-12-29-23/h4-12H,13-19H2,1-3H3/b10-7+