N-[4,6-bis(hexylamino)-2-methyl-pyrimidin-5-yl]-4-[phenyl(propyl)amino]butanamide

Systemtic Name: N-[4,6-bis(hexylamino)-2-methyl-pyrimidin-5-yl]-4-[phenyl(propyl)amino]butanamide Openeye Name: N-[4,6-bis(hexylamino)-2-methyl-pyrimidin-5-yl]-4-(N-propylanilino)butanamide CAS Name: N-[4,6-bis(hexylamino)-2-methyl-5-pyrimidinyl]-4-(N-propylanilino)butanamide IUPAC Name: N-[4,6-bis(hexylamino)-2-methylpyrimidin-5-yl]-4-(N-propylanilino)butanamide Traditional Name: N-[4,6-bis(hexylamino)-2-methyl-pyrimidin-5-yl]-4-(N-propylanilino)butyramide Formula: C30H50N6O MolecularWeight: 510.7576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=C(C(=NC(=N1)C)NCCCCCC)NC(=O)CCCN(CCC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCNC1=C(C(=NC(=N1)C)NCCCCCC)NC(=O)CCCN(CCC)C2=CC=CC=C2

InChI

InChI=1S/C30H50N6O/c1-5-8-10-15-21-31-29-28(30(34-25(4)33-29)32-22-16-11-9-6-2)35-27(37)20-17-24-36(23-7-3)26-18-13-12-14-19-26/h12-14,18-19H,5-11,15-17,20-24H2,1-4H3,(H,35,37)(H2,31,32,33,34)