1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanone Openeye Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanone CAS Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[[4-(ethylamino)-2-quinazolinyl]thio]ethanone IUPAC Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanylethanone Traditional Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[[4-(ethylamino)quinazolin-2-yl]thio]ethanone Formula: C18H20N4OS MolecularWeight: 340.4426

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)C3=C(NC(=C3)C)C

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)C3=C(NC(=C3)C)C

InChI

InChI=1S/C18H20N4OS/c1-4-19-17-13-7-5-6-8-15(13)21-18(22-17)24-10-16(23)14-9-11(2)20-12(14)3/h5-9,20H,4,10H2,1-3H3,(H,19,21,22)