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

Systemtic Name: 2-[3-[2,6-bis(azanyl)purin-9-yl]propyl]-1-[4-[(6-chloranyl-2-methoxy-acridin-9-yl)amino]butyl]guanidine Openeye Name: 1-[4-[(6-chloro-2-methoxy-acridin-9-yl)amino]butyl]-2-[3-(2,6-diaminopurin-9-yl)propyl]guanidine CAS Name: 1-[4-[(6-chloro-2-methoxy-9-acridinyl)amino]butyl]-2-[3-(2,6-diamino-9-purinyl)propyl]guanidine IUPAC Name: 1-[4-[(6-chloro-2-methoxyacridin-9-yl)amino]butyl]-2-[3-(2,6-diaminopurin-9-yl)propyl]guanidine Traditional Name: 1-[4-[(6-chloro-2-methoxy-acridin-9-yl)amino]butyl]-2-[3-(2,6-diaminopurin-9-yl)propyl]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(=NCCCN4C=NC5=C4N=C(N=C5N)N)N

Isomeric SMILES

COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCCNC(=NCCCN4C=NC5=C4N=C(N=C5N)N)N

InChI

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