6-azanyl-3-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl]-5-piperidin-1-yl-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl]-5-piperidin-1-yl-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-3-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl]-5-(1-piperidyl)-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-3-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl]-5-(1-piperidinyl)-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-3-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl]-5-piperidin-1-yl-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-3-[(4-amino-6-anilino-s-triazin-2-yl)methyl]-5-piperidino-1-propyl-pyrimidine-2,4-quinone Formula: C22H29N9O2 MolecularWeight: 451.52476

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)CC2=NC(=NC(=N2)NC3=CC=CC=C3)N)N4CCCCC4)N

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)CC2=NC(=NC(=N2)NC3=CC=CC=C3)N)N4CCCCC4)N

InChI

InChI=1S/C22H29N9O2/c1-2-11-30-18(23)17(29-12-7-4-8-13-29)19(32)31(22(30)33)14-16-26-20(24)28-21(27-16)25-15-9-5-3-6-10-15/h3,5-6,9-10H,2,4,7-8,11-14,23H2,1H3,(H3,24,25,26,27,28)