(2R)-N-(2-nitrophenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(2-nitrophenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(2-nitrophenyl)-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]propanamide CAS Name: (2R)-N-(2-nitrophenyl)-2-[(4,6,8-trimethyl-2-quinolinyl)thio]propanamide IUPAC Name: (2R)-N-(2-nitrophenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(2-nitrophenyl)-2-[(4,6,8-trimethyl-2-quinolyl)thio]propionamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SC(C)C(=O)NC3=CC=CC=C3[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)S[C@H](C)C(=O)NC3=CC=CC=C3[N+](=O)[O-])C)C

InChI

InChI=1S/C21H21N3O3S/c1-12-9-14(3)20-16(10-12)13(2)11-19(23-20)28-15(4)21(25)22-17-7-5-6-8-18(17)24(26)27/h5-11,15H,1-4H3,(H,22,25)/t15-/m1/s1