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

Systemtic Name: N-cyclopentyl-2-[4-oxidanylidene-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-cyclopentyl-2-[4-oxo-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-cyclopentyl-2-[[4-oxo-3-(4-phenoxyphenyl)-2-quinazolinyl]thio]propanamide IUPAC Name: N-cyclopentyl-2-[4-oxo-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanylpropanamide Traditional Name: N-cyclopentyl-2-[[4-keto-3-(4-phenoxyphenyl)quinazolin-2-yl]thio]propionamide Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC(C(=O)NC1CCCC1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H27N3O3S/c1-19(26(32)29-20-9-5-6-10-20)35-28-30-25-14-8-7-13-24(25)27(33)31(28)21-15-17-23(18-16-21)34-22-11-3-2-4-12-22/h2-4,7-8,11-20H,5-6,9-10H2,1H3,(H,29,32)