(2R)-N-(4-fluoranyl-3-nitro-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-fluoranyl-3-nitro-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(4-fluoro-3-nitro-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide CAS Name: (2R)-N-(4-fluoro-3-nitrophenyl)-2-[(2-methyl-4-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-(4-fluoro-3-nitrophenyl)-2-(2-methylquinazolin-4-yl)sulfanylpropanamide Traditional Name: (2R)-N-(4-fluoro-3-nitro-phenyl)-2-[(2-methylquinazolin-4-yl)thio]propionamide Formula: C18H15FN4O3S MolecularWeight: 386.400103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SC(C)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)S[C@H](C)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H15FN4O3S/c1-10(17(24)22-12-7-8-14(19)16(9-12)23(25)26)27-18-13-5-3-4-6-15(13)20-11(2)21-18/h3-10H,1-2H3,(H,22,24)/t10-/m1/s1