2-[4-(dipentylamino)-6-phenylazanyl-1,3,5-triazin-2-yl]-1-phenyl-ethanone

Systemtic Name: 2-[4-(dipentylamino)-6-phenylazanyl-1,3,5-triazin-2-yl]-1-phenyl-ethanone Openeye Name: 2-[4-anilino-6-(dipentylamino)-1,3,5-triazin-2-yl]-1-phenyl-ethanone CAS Name: 2-[4-anilino-6-(dipentylamino)-1,3,5-triazin-2-yl]-1-phenylethanone IUPAC Name: 2-[4-anilino-6-(dipentylamino)-1,3,5-triazin-2-yl]-1-phenylethanone Traditional Name: 2-[4-anilino-6-(diamylamino)-s-triazin-2-yl]-1-phenyl-ethanone Formula: C27H35N5O MolecularWeight: 445.5997

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C1=NC(=NC(=N1)NC2=CC=CC=C2)CC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCN(CCCCC)C1=NC(=NC(=N1)NC2=CC=CC=C2)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H35N5O/c1-3-5-13-19-32(20-14-6-4-2)27-30-25(21-24(33)22-15-9-7-10-16-22)29-26(31-27)28-23-17-11-8-12-18-23/h7-12,15-18H,3-6,13-14,19-21H2,1-2H3,(H,28,29,30,31)