(2S)-2-(3-ethyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-N-propyl-propanamide

Systemtic Name: (2S)-2-(3-ethyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-N-propyl-propanamide Openeye Name: (2S)-2-(3-ethyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-N-propyl-propanamide CAS Name: (2S)-2-[(3-ethyl-4-oxo-2-benzo[g]quinazolinyl)thio]-N-propylpropanamide IUPAC Name: (2S)-2-(3-ethyl-4-oxobenzo[g]quinazolin-2-yl)sulfanyl-N-propylpropanamide Traditional Name: (2S)-2-[(3-ethyl-4-keto-benzo[g]quinazolin-2-yl)thio]-N-propyl-propionamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NC2=CC3=CC=CC=C3C=C2C(=O)N1CC

Isomeric SMILES

CCCNC(=O)[C@H](C)SC1=NC2=CC3=CC=CC=C3C=C2C(=O)N1CC

InChI

InChI=1S/C20H23N3O2S/c1-4-10-21-18(24)13(3)26-20-22-17-12-15-9-7-6-8-14(15)11-16(17)19(25)23(20)5-2/h6-9,11-13H,4-5,10H2,1-3H3,(H,21,24)/t13-/m0/s1