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

Systemtic Name: (2R)-N-cyclopropyl-2-(3-ethyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-cyclopropyl-2-(3-ethyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-cyclopropyl-2-[(3-ethyl-4-oxo-2-benzo[g]quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-cyclopropyl-2-(3-ethyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-cyclopropyl-2-[(3-ethyl-4-keto-benzo[g]quinazolin-2-yl)thio]propionamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SC(C)C(=O)NC4CC4

Isomeric SMILES

CCN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1S[C@H](C)C(=O)NC4CC4

InChI

InChI=1S/C20H21N3O2S/c1-3-23-19(25)16-10-13-6-4-5-7-14(13)11-17(16)22-20(23)26-12(2)18(24)21-15-8-9-15/h4-7,10-12,15H,3,8-9H2,1-2H3,(H,21,24)/t12-/m1/s1