(2R)-N-tert-butyl-2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-tert-butyl-2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-tert-butyl-2-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-N-tert-butyl-2-[[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-tert-butyl-2-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-tert-butyl-2-[(4-keto-3-p-phenetyl-quinazolin-2-yl)thio]propionamide Formula: C23H27N3O3S MolecularWeight: 425.54378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)NC(C)(C)C

InChI

InChI=1S/C23H27N3O3S/c1-6-29-17-13-11-16(12-14-17)26-21(28)18-9-7-8-10-19(18)24-22(26)30-15(2)20(27)25-23(3,4)5/h7-15H,6H2,1-5H3,(H,25,27)/t15-/m1/s1