(2R)-N-tert-butyl-2-(3-ethyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-tert-butyl-2-(3-ethyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-tert-butyl-2-(3-ethyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-tert-butyl-2-[(3-ethyl-4-oxo-2-benzo[g]quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-tert-butyl-2-(3-ethyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-tert-butyl-2-[(3-ethyl-4-keto-benzo[g]quinazolin-2-yl)thio]propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SC(C)C(=O)NC(C)(C)C

Isomeric SMILES

CCN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1S[C@H](C)C(=O)NC(C)(C)C

InChI

InChI=1S/C21H25N3O2S/c1-6-24-19(26)16-11-14-9-7-8-10-15(14)12-17(16)22-20(24)27-13(2)18(25)23-21(3,4)5/h7-13H,6H2,1-5H3,(H,23,25)/t13-/m1/s1