4-methylsulfanyl-N-[3-[4-[3-[(4-methylsulfanylacridin-9-yl)amino]propyl]piperazin-1-yl]propyl]acridin-9-amine

Systemtic Name: 4-methylsulfanyl-N-[3-[4-[3-[(4-methylsulfanylacridin-9-yl)amino]propyl]piperazin-1-yl]propyl]acridin-9-amine Openeye Name: 4-methylsulfanyl-N-[3-[4-[3-[(4-methylsulfanylacridin-9-yl)amino]propyl]piperazin-1-yl]propyl]acridin-9-amine CAS Name: 4-(methylthio)-N-[3-[4-[3-[[4-(methylthio)-9-acridinyl]amino]propyl]-1-piperazinyl]propyl]-9-acridinamine IUPAC Name: 4-methylsulfanyl-N-[3-[4-[3-[(4-methylsulfanylacridin-9-yl)amino]propyl]piperazin-1-yl]propyl]acridin-9-amine Traditional Name: [4-(methylthio)acridin-9-yl]-[3-[4-[3-[[4-(methylthio)acridin-9-yl]amino]propyl]piperazino]propyl]amine Formula: C38H42N6S2 MolecularWeight: 646.91028

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC2=C(C3=CC=CC=C3N=C21)NCCCN4CCN(CC4)CCCNC5=C6C=CC=C(C6=NC7=CC=CC=C75)SC

Isomeric SMILES

CSC1=CC=CC2=C(C3=CC=CC=C3N=C21)NCCCN4CCN(CC4)CCCNC5=C6C=CC=C(C6=NC7=CC=CC=C75)SC

InChI

InChI=1S/C38H42N6S2/c1-45-33-17-7-13-29-35(27-11-3-5-15-31(27)41-37(29)33)39-19-9-21-43-23-25-44(26-24-43)22-10-20-40-36-28-12-4-6-16-32(28)42-38-30(36)14-8-18-34(38)46-2/h3-8,11-18H,9-10,19-26H2,1-2H3,(H,39,41)(H,40,42)