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

Systemtic Name: N-cyclopentyl-2-[3-(3,4-dimethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-cyclopentyl-2-[3-(3,4-dimethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-cyclopentyl-2-[[3-(3,4-dimethoxyphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-cyclopentyl-2-[3-(3,4-dimethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-cyclopentyl-2-[[3-(3,4-dimethoxyphenyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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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)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3O4S/c1-15(22(28)25-16-8-4-5-9-16)32-24-26-19-11-7-6-10-18(19)23(29)27(24)17-12-13-20(30-2)21(14-17)31-3/h6-7,10-16H,4-5,8-9H2,1-3H3,(H,25,28)