2-azanyl-5-[bis(azanyl)methylideneamino]-N-[6-(6-chloranyl-9-methyl-acridin-2-yl)oxyhexyl]pentanamide

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]-N-[6-(6-chloranyl-9-methyl-acridin-2-yl)oxyhexyl]pentanamide Openeye Name: 2-amino-N-[6-(6-chloro-9-methyl-acridin-2-yl)oxyhexyl]-5-guanidino-pentanamide CAS Name: 2-amino-N-[6-[(6-chloro-9-methyl-2-acridinyl)oxy]hexyl]-5-(diaminomethylideneamino)pentanamide IUPAC Name: 2-amino-N-[6-(6-chloro-9-methylacridin-2-yl)oxyhexyl]-5-(diaminomethylideneamino)pentanamide Traditional Name: 2-amino-N-[6-(6-chloro-9-methyl-acridin-2-yl)oxyhexyl]-5-guanidino-valeramide Formula: C26H35ClN6O2 MolecularWeight: 499.0481

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=CC2=NC3=C1C=C(C=C3)OCCCCCCNC(=O)C(CCCN=C(N)N)N)Cl

Isomeric SMILES

CC1=C2C=CC(=CC2=NC3=C1C=C(C=C3)OCCCCCCNC(=O)C(CCCN=C(N)N)N)Cl

InChI

InChI=1S/C26H35ClN6O2/c1-17-20-10-8-18(27)15-24(20)33-23-11-9-19(16-21(17)23)35-14-5-3-2-4-12-31-25(34)22(28)7-6-13-32-26(29)30/h8-11,15-16,22H,2-7,12-14,28H2,1H3,(H,31,34)(H4,29,30,32)