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

Systemtic Name: (2S)-2-[3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-propyl-propanamide Openeye Name: (2S)-2-[3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-propyl-propanamide CAS Name: (2S)-2-[[3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-N-propylpropanamide IUPAC Name: (2S)-2-[3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-propylpropanamide Traditional Name: (2S)-2-[[4-keto-3-(2-methoxyphenyl)quinazolin-2-yl]thio]-N-propyl-propionamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3OC

Isomeric SMILES

CCCNC(=O)[C@H](C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3OC

InChI

InChI=1S/C21H23N3O3S/c1-4-13-22-19(25)14(2)28-21-23-16-10-6-5-9-15(16)20(26)24(21)17-11-7-8-12-18(17)27-3/h5-12,14H,4,13H2,1-3H3,(H,22,25)/t14-/m0/s1