N2,N4,N7-tributyl-5-methyl-6-(phenylmethyl)pyrido[2,3-d]pyrimidine-2,4,7-triamine

Systemtic Name: N2,N4,N7-tributyl-5-methyl-6-(phenylmethyl)pyrido[2,3-d]pyrimidine-2,4,7-triamine Openeye Name: 6-benzyl-N2,N4,N7-tributyl-5-methyl-pyrido[2,3-d]pyrimidine-2,4,7-triamine CAS Name: N2,N4,N7-tributyl-5-methyl-6-(phenylmethyl)pyrido[2,3-d]pyrimidine-2,4,7-triamine IUPAC Name: 6-benzyl-2-N,4-N,7-N-tributyl-5-methylpyrido[2,3-d]pyrimidine-2,4,7-triamine Traditional Name: [6-benzyl-2,4-bis(butylamino)-5-methyl-pyrido[2,3-d]pyrimidin-7-yl]-butyl-amine Formula: C27H40N6 MolecularWeight: 448.6467

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=C2C(=N1)N=C(N=C2NCCCC)NCCCC)C)CC3=CC=CC=C3

Isomeric SMILES

CCCCNC1=C(C(=C2C(=N1)N=C(N=C2NCCCC)NCCCC)C)CC3=CC=CC=C3

InChI

InChI=1S/C27H40N6/c1-5-8-16-28-24-22(19-21-14-12-11-13-15-21)20(4)23-25(29-17-9-6-2)32-27(30-18-10-7-3)33-26(23)31-24/h11-15H,5-10,16-19H2,1-4H3,(H3,28,29,30,31,32,33)