N-[2-ethanoyl-5-[(E)-4-oxidanylidene-4-(4-phenylpiperazin-1-yl)but-2-en-2-yl]-1-benzofuran-3-yl]-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[2-ethanoyl-5-[(E)-4-oxidanylidene-4-(4-phenylpiperazin-1-yl)but-2-en-2-yl]-1-benzofuran-3-yl]-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: N-[2-acetyl-5-[(E)-1-methyl-3-oxo-3-(4-phenylpiperazin-1-yl)prop-1-enyl]benzofuran-3-yl]-5-methyl-isoxazole-4-carboxamide CAS Name: N-[2-acetyl-5-[(E)-4-oxo-4-(4-phenyl-1-piperazinyl)but-2-en-2-yl]-3-benzofuranyl]-5-methyl-4-isoxazolecarboxamide IUPAC Name: N-[2-acetyl-5-[(E)-4-oxo-4-(4-phenylpiperazin-1-yl)but-2-en-2-yl]-1-benzofuran-3-yl]-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: N-[2-acetyl-5-[(E)-3-keto-1-methyl-3-(4-phenylpiperazino)prop-1-enyl]benzofuran-3-yl]-5-methyl-isoxazole-4-carboxamide Formula: C29H28N4O5 MolecularWeight: 512.55642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NO1)C(=O)NC2=C(OC3=C2C=C(C=C3)C(=CC(=O)N4CCN(CC4)C5=CC=CC=C5)C)C(=O)C

Isomeric SMILES

CC1=C(C=NO1)C(=O)NC2=C(OC3=C2C=C(C=C3)/C(=C/C(=O)N4CCN(CC4)C5=CC=CC=C5)/C)C(=O)C

InChI

InChI=1S/C29H28N4O5/c1-18(15-26(35)33-13-11-32(12-14-33)22-7-5-4-6-8-22)21-9-10-25-23(16-21)27(28(37-25)19(2)34)31-29(36)24-17-30-38-20(24)3/h4-10,15-17H,11-14H2,1-3H3,(H,31,36)/b18-15+