N-[2-(2,4-dimethylpyrido[2,3-b]indol-9-yl)ethylcarbamothioyl]furan-2-carboxamide

Systemtic Name: N-[2-(2,4-dimethylpyrido[2,3-b]indol-9-yl)ethylcarbamothioyl]furan-2-carboxamide Openeye Name: N-[2-(2,4-dimethylpyrido[2,3-b]indol-9-yl)ethylcarbamothioyl]furan-2-carboxamide CAS Name: N-[[2-(2,4-dimethyl-9-pyrido[2,3-b]indolyl)ethylamino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[2-(2,4-dimethylpyrido[2,3-b]indol-9-yl)ethylcarbamothioyl]furan-2-carboxamide Traditional Name: N-[2-(2,4-dimethylpyrid[2,3-b]indol-9-yl)ethylthiocarbamoyl]-2-furamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C3=CC=CC=C3N2CCNC(=S)NC(=O)C4=CC=CO4)C

Isomeric SMILES

CC1=CC(=NC2=C1C3=CC=CC=C3N2CCNC(=S)NC(=O)C4=CC=CO4)C

InChI

InChI=1S/C21H20N4O2S/c1-13-12-14(2)23-19-18(13)15-6-3-4-7-16(15)25(19)10-9-22-21(28)24-20(26)17-8-5-11-27-17/h3-8,11-12H,9-10H2,1-2H3,(H2,22,24,26,28)