(2R)-N-cyclopropyl-2-[3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-cyclopropyl-2-[3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-cyclopropyl-2-[3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-N-cyclopropyl-2-[[3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-cyclopropyl-2-[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-cyclopropyl-2-[[4-keto-3-(4-methoxyphenyl)quinazolin-2-yl]thio]propionamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC

Isomeric SMILES

C[C@H](C(=O)NC1CC1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H21N3O3S/c1-13(19(25)22-14-7-8-14)28-21-23-18-6-4-3-5-17(18)20(26)24(21)15-9-11-16(27-2)12-10-15/h3-6,9-14H,7-8H2,1-2H3,(H,22,25)/t13-/m1/s1