(2R)-N-(3-methoxyphenyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1S[C@H](C)C(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H23N3O3S/c1-4-12-24-20(26)17-10-5-6-11-18(17)23-21(24)28-14(2)19(25)22-15-8-7-9-16(13-15)27-3/h5-11,13-14H,4,12H2,1-3H3,(H,22,25)/t14-/m1/s1