(2R)-N-cyclopentyl-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-cyclopentyl-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-cyclopentyl-2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-N-cyclopentyl-2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-cyclopentyl-2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-cyclopentyl-2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]propionamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)NC4CCCC4

InChI

InChI=1S/C23H25N3O2S/c1-15-11-13-18(14-12-15)26-22(28)19-9-5-6-10-20(19)25-23(26)29-16(2)21(27)24-17-7-3-4-8-17/h5-6,9-14,16-17H,3-4,7-8H2,1-2H3,(H,24,27)/t16-/m1/s1