N2-(2-methyl-1-benzofuran-7-yl)-N5-(2-methylsulfanylethyl)quinoline-2,5-diamine

Systemtic Name: N2-(2-methyl-1-benzofuran-7-yl)-N5-(2-methylsulfanylethyl)quinoline-2,5-diamine Openeye Name: N2-(2-methylbenzofuran-7-yl)-N5-(2-methylsulfanylethyl)quinoline-2,5-diamine CAS Name: N2-(2-methyl-7-benzofuranyl)-N5-[2-(methylthio)ethyl]quinoline-2,5-diamine IUPAC Name: 2-N-(2-methyl-1-benzofuran-7-yl)-5-N-(2-methylsulfanylethyl)quinoline-2,5-diamine Traditional Name: (2-methylbenzofuran-7-yl)-[5-[2-(methylthio)ethylamino]-2-quinolyl]amine Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(O1)C(=CC=C2)NC3=NC4=C(C=C3)C(=CC=C4)NCCSC

Isomeric SMILES

CC1=CC2=C(O1)C(=CC=C2)NC3=NC4=C(C=C3)C(=CC=C4)NCCSC

InChI

InChI=1S/C21H21N3OS/c1-14-13-15-5-3-8-19(21(15)25-14)24-20-10-9-16-17(22-11-12-26-2)6-4-7-18(16)23-20/h3-10,13,22H,11-12H2,1-2H3,(H,23,24)