1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-[(2-methyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-(2-methylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[(2-methylquinazolin-4-yl)thio]ethanone Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)CSC2=NC(=NC3=CC=CC=C32)C

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)CSC2=NC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C20H23N3OS/c1-12(2)23-13(3)10-17(14(23)4)19(24)11-25-20-16-8-6-7-9-18(16)21-15(5)22-20/h6-10,12H,11H2,1-5H3