N-[2-[4-[2-chloroethyl(ethyl)amino]phenyl]sulfanylethyl]-9-oxidanylidene-10H-acridine-4-carboxamide

Systemtic Name: N-[2-[4-[2-chloroethyl(ethyl)amino]phenyl]sulfanylethyl]-9-oxidanylidene-10H-acridine-4-carboxamide Openeye Name: N-[2-[4-[2-chloroethyl(ethyl)amino]phenyl]sulfanylethyl]-9-oxo-10H-acridine-4-carboxamide CAS Name: N-[2-[[4-[2-chloroethyl(ethyl)amino]phenyl]thio]ethyl]-9-oxo-10H-acridine-4-carboxamide IUPAC Name: N-[2-[4-[2-chloroethyl(ethyl)amino]phenyl]sulfanylethyl]-9-oxo-10H-acridine-4-carboxamide Traditional Name: N-[2-[[4-[2-chloroethyl(ethyl)amino]phenyl]thio]ethyl]-9-keto-10H-acridine-4-carboxamide Formula: C26H26ClN3O2S MolecularWeight: 480.02154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCl)C1=CC=C(C=C1)SCCNC(=O)C2=CC=CC3=C2NC4=CC=CC=C4C3=O

Isomeric SMILES

CCN(CCCl)C1=CC=C(C=C1)SCCNC(=O)C2=CC=CC3=C2NC4=CC=CC=C4C3=O

InChI

InChI=1S/C26H26ClN3O2S/c1-2-30(16-14-27)18-10-12-19(13-11-18)33-17-15-28-26(32)22-8-5-7-21-24(22)29-23-9-4-3-6-20(23)25(21)31/h3-13H,2,14-17H2,1H3,(H,28,32)(H,29,31)