[1-ethanoyl-3-[3-(4-methoxycarbonyl-4-phenyl-piperidin-1-yl)propylcarbamoyl]-6-methylidene-2-phenyl-2H-1,3,5-triazin-4-yl]boron

Systemtic Name: [1-ethanoyl-3-[3-(4-methoxycarbonyl-4-phenyl-piperidin-1-yl)propylcarbamoyl]-6-methylidene-2-phenyl-2H-1,3,5-triazin-4-yl]boron Openeye Name: [1-acetyl-3-[3-(4-methoxycarbonyl-4-phenyl-1-piperidyl)propylcarbamoyl]-6-methylene-2-phenyl-2H-1,3,5-triazin-4-yl]boron CAS Name: [1-acetyl-3-[[3-(4-methoxycarbonyl-4-phenyl-1-piperidinyl)propylamino]-oxomethyl]-6-methylene-2-phenyl-2H-1,3,5-triazin-4-yl]boron IUPAC Name: [1-acetyl-3-[3-(4-methoxycarbonyl-4-phenylpiperidin-1-yl)propylcarbamoyl]-6-methylidene-2-phenyl-2H-1,3,5-triazin-4-yl]boron Traditional Name: [1-acetyl-3-[3-(4-carbomethoxy-4-phenyl-piperidino)propylcarbamoyl]-6-methylene-2-phenyl-2H-s-triazin-4-yl]boron Formula: C29H34BN5O4 MolecularWeight: 527.42236

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Descriptors Computed from Structure

Canonical SMILES:

[B]C1=NC(=C)N(C(N1C(=O)NCCCN2CCC(CC2)(C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4)C(=O)C

Isomeric SMILES

[B]C1=NC(=C)N(C(N1C(=O)NCCCN2CCC(CC2)(C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C29H34BN5O4/c1-21-32-27(30)35(25(34(21)22(2)36)23-11-6-4-7-12-23)28(38)31-17-10-18-33-19-15-29(16-20-33,26(37)39-3)24-13-8-5-9-14-24/h4-9,11-14,25H,1,10,15-20H2,2-3H3,(H,31,38)