7-chloranyl-N-[3-(2-diethylaminoethylsulfanyl)propyl]-2-methoxy-5-oxidanylidene-5aH-benzo[b][1,5]naphthyridin-5-ium-10-amine

Systemtic Name: 7-chloranyl-N-[3-(2-diethylaminoethylsulfanyl)propyl]-2-methoxy-5-oxidanylidene-5aH-benzo[b][1,5]naphthyridin-5-ium-10-amine Openeye Name: 7-chloro-N-[3-(2-diethylaminoethylsulfanyl)propyl]-2-methoxy-5-oxo-5aH-benzo[b][1,5]naphthyridin-5-ium-10-amine CAS Name: 7-chloro-N-[3-(2-diethylaminoethylthio)propyl]-2-methoxy-5-oxo-5aH-benzo[b][1,5]naphthyridin-5-ium-10-amine IUPAC Name: 7-chloro-N-[3-(2-diethylaminoethylsulfanyl)propyl]-2-methoxy-5-oxo-5aH-benzo[b][1,5]naphthyridin-5-ium-10-amine Traditional Name: 2-[3-[(7-chloro-5-keto-2-methoxy-5aH-benzo[b][1,5]naphthyridin-5-ium-10-yl)amino]propylthio]ethyl-diethyl-amine Formula: C22H30ClN4O2S+ MolecularWeight: 450.0172

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSCCCNC1=C2C=CC(=CC2[N+](=O)C3=C1N=C(C=C3)OC)Cl

Isomeric SMILES

CCN(CC)CCSCCCNC1=C2C=CC(=CC2[N+](=O)C3=C1N=C(C=C3)OC)Cl

InChI

InChI=1S/C22H30ClN4O2S/c1-4-26(5-2)12-14-30-13-6-11-24-21-17-8-7-16(23)15-19(17)27(28)18-9-10-20(29-3)25-22(18)21/h7-10,15,19,24H,4-6,11-14H2,1-3H3/q+1