2-(2-diethylaminoethyl)-10-methyl-5-methylsulfanyl-pyrrolo[3,4-a]carbazole-1,3-dione

Systemtic Name: 2-(2-diethylaminoethyl)-10-methyl-5-methylsulfanyl-pyrrolo[3,4-a]carbazole-1,3-dione Openeye Name: 2-(2-diethylaminoethyl)-10-methyl-5-methylsulfanyl-pyrrolo[3,4-a]carbazole-1,3-dione CAS Name: 2-(2-diethylaminoethyl)-10-methyl-5-(methylthio)pyrrolo[3,4-a]carbazole-1,3-dione IUPAC Name: 2-(2-diethylaminoethyl)-10-methyl-5-methylsulfanylpyrrolo[3,4-a]carbazole-1,3-dione Traditional Name: 2-(2-diethylaminoethyl)-10-methyl-5-(methylthio)pyrrolo[3,4-a]carbazole-1,3-quinone Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(=O)C2=CC(=C3C4=CC=CC=C4N(C3=C2C1=O)C)SC

Isomeric SMILES

CCN(CC)CCN1C(=O)C2=CC(=C3C4=CC=CC=C4N(C3=C2C1=O)C)SC

InChI

InChI=1S/C22H25N3O2S/c1-5-24(6-2)11-12-25-21(26)15-13-17(28-4)18-14-9-7-8-10-16(14)23(3)20(18)19(15)22(25)27/h7-10,13H,5-6,11-12H2,1-4H3