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

Systemtic Name: (2R)-2-(3-ethyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-N-(propan-2-ylcarbamoyl)propanamide Openeye Name: (2R)-2-(3-ethyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-N-(isopropylcarbamoyl)propanamide CAS Name: (2R)-2-[(3-ethyl-4-oxo-2-benzo[g]quinazolinyl)thio]-N-[oxo-(propan-2-ylamino)methyl]propanamide IUPAC Name: (2R)-2-(3-ethyl-4-oxobenzo[g]quinazolin-2-yl)sulfanyl-N-(propan-2-ylcarbamoyl)propanamide Traditional Name: (2R)-2-[(3-ethyl-4-keto-benzo[g]quinazolin-2-yl)thio]-N-(isopropylcarbamoyl)propionamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O3S/c1-5-25-19(27)16-10-14-8-6-7-9-15(14)11-17(16)23-21(25)29-13(4)18(26)24-20(28)22-12(2)3/h6-13H,5H2,1-4H3,(H2,22,24,26,28)/t13-/m1/s1