2-[3-[(6-azanyl-7H-purin-2-yl)amino]propyl]-1-[4-[(6-chloranyl-2-methoxy-acridin-9-yl)amino]butyl]guanidine

Systemtic Name: 2-[3-[(6-azanyl-7H-purin-2-yl)amino]propyl]-1-[4-[(6-chloranyl-2-methoxy-acridin-9-yl)amino]butyl]guanidine Openeye Name: 2-[3-[(6-amino-7H-purin-2-yl)amino]propyl]-1-[4-[(6-chloro-2-methoxy-acridin-9-yl)amino]butyl]guanidine CAS Name: 2-[3-[(6-amino-7H-purin-2-yl)amino]propyl]-1-[4-[(6-chloro-2-methoxy-9-acridinyl)amino]butyl]guanidine IUPAC Name: 2-[3-[(6-amino-7H-purin-2-yl)amino]propyl]-1-[4-[(6-chloro-2-methoxyacridin-9-yl)amino]butyl]guanidine Traditional Name: 2-[3-[(6-amino-7H-purin-2-yl)amino]propyl]-1-[4-[(6-chloro-2-methoxy-acridin-9-yl)amino]butyl]guanidine Formula: C27H32ClN11O MolecularWeight: 562.06908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCCNC(=NCCCNC4=NC5=C(C(=N4)N)NC=N5)N

Isomeric SMILES

COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCCNC(=NCCCNC4=NC5=C(C(=N4)N)NC=N5)N

InChI

InChI=1S/C27H32ClN11O/c1-40-17-6-8-20-19(14-17)22(18-7-5-16(28)13-21(18)37-20)31-9-2-3-10-32-26(30)33-11-4-12-34-27-38-24(29)23-25(39-27)36-15-35-23/h5-8,13-15H,2-4,9-12H2,1H3,(H,31,37)(H3,30,32,33)(H4,29,34,35,36,38,39)