N1,N1-diethyl-N4-(5-methylsulfanyl-2-nitro-acridin-9-yl)pentane-1,4-diamine

Systemtic Name: N1,N1-diethyl-N4-(5-methylsulfanyl-2-nitro-acridin-9-yl)pentane-1,4-diamine Openeye Name: N1,N1-diethyl-N4-(5-methylsulfanyl-2-nitro-acridin-9-yl)pentane-1,4-diamine CAS Name: N1,N1-diethyl-N4-[5-(methylthio)-2-nitro-9-acridinyl]pentane-1,4-diamine IUPAC Name: 1-N,1-N-diethyl-4-N-(5-methylsulfanyl-2-nitroacridin-9-yl)pentane-1,4-diamine Traditional Name: diethyl-[4-[[5-(methylthio)-2-nitro-acridin-9-yl]amino]pentyl]amine Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC1=C2C=C(C=CC2=NC3=C1C=CC=C3SC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCCC(C)NC1=C2C=C(C=CC2=NC3=C1C=CC=C3SC)[N+](=O)[O-]

InChI

InChI=1S/C23H30N4O2S/c1-5-26(6-2)14-8-9-16(3)24-22-18-10-7-11-21(30-4)23(18)25-20-13-12-17(27(28)29)15-19(20)22/h7,10-13,15-16H,5-6,8-9,14H2,1-4H3,(H,24,25)