1-[4-[3,5-bis(azanyl)piperidin-1-yl]-6-[methyl-[1-(phenylmethyl)pyrrolidin-3-yl]amino]-1,3,5-triazin-2-yl]piperidine-3,5-diamine

Systemtic Name: 1-[4-[3,5-bis(azanyl)piperidin-1-yl]-6-[methyl-[1-(phenylmethyl)pyrrolidin-3-yl]amino]-1,3,5-triazin-2-yl]piperidine-3,5-diamine Openeye Name: 1-[4-[(1-benzylpyrrolidin-3-yl)-methyl-amino]-6-(3,5-diamino-1-piperidyl)-1,3,5-triazin-2-yl]piperidine-3,5-diamine CAS Name: 1-[4-(3,5-diamino-1-piperidinyl)-6-[methyl-[1-(phenylmethyl)-3-pyrrolidinyl]amino]-1,3,5-triazin-2-yl]piperidine-3,5-diamine IUPAC Name: 1-[4-[(1-benzylpyrrolidin-3-yl)-methylamino]-6-(3,5-diaminopiperidin-1-yl)-1,3,5-triazin-2-yl]piperidine-3,5-diamine Traditional Name: (1-benzylpyrrolidin-3-yl)-[4,6-bis(3,5-diaminopiperidino)-s-triazin-2-yl]-methyl-amine Formula: C25H41N11 MolecularWeight: 495.66674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(C1)CC2=CC=CC=C2)C3=NC(=NC(=N3)N4CC(CC(C4)N)N)N5CC(CC(C5)N)N

Isomeric SMILES

CN(C1CCN(C1)CC2=CC=CC=C2)C3=NC(=NC(=N3)N4CC(CC(C4)N)N)N5CC(CC(C5)N)N

InChI

InChI=1S/C25H41N11/c1-33(22-7-8-34(16-22)11-17-5-3-2-4-6-17)23-30-24(35-12-18(26)9-19(27)13-35)32-25(31-23)36-14-20(28)10-21(29)15-36/h2-6,18-22H,7-16,26-29H2,1H3