N-butan-2-yl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[[(E)-3-phenylprop-2-enoyl]amino]benzamide

Systemtic Name: N-butan-2-yl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[[(E)-3-phenylprop-2-enoyl]amino]benzamide Openeye Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[[(E)-3-phenylprop-2-enoyl]amino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[[(E)-3-phenylprop-2-enoyl]amino]benzamide Traditional Name: 2-[4-(2-methoxyphenyl)piperazino]-5-[[(E)-3-phenylacryloyl]amino]-N-sec-butyl-benzamide Formula: C31H36N4O3 MolecularWeight: 512.64254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C=CC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)/C=C/C2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C31H36N4O3/c1-4-23(2)32-31(37)26-22-25(33-30(36)17-14-24-10-6-5-7-11-24)15-16-27(26)34-18-20-35(21-19-34)28-12-8-9-13-29(28)38-3/h5-17,22-23H,4,18-21H2,1-3H3,(H,32,37)(H,33,36)/b17-14+