(2R)-N-(cyclopropylcarbamoyl)-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(cyclopropylcarbamoyl)-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(cyclopropylcarbamoyl)-2-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-N-[(cyclopropylamino)-oxomethyl]-2-[[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-(cyclopropylcarbamoyl)-2-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(cyclopropylcarbamoyl)-2-[[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC(=O)NC4CC4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)NC(=O)NC4CC4

InChI

InChI=1S/C23H24N4O3S/c1-3-15-8-12-17(13-9-15)27-21(29)18-6-4-5-7-19(18)25-23(27)31-14(2)20(28)26-22(30)24-16-10-11-16/h4-9,12-14,16H,3,10-11H2,1-2H3,(H2,24,26,28,30)/t14-/m1/s1