2-methyl-N-[4-[2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylpropanoyl]phenyl]propanamide

Systemtic Name: 2-methyl-N-[4-[2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylpropanoyl]phenyl]propanamide Openeye Name: N-[4-[2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoyl]phenyl]-2-methyl-propanamide CAS Name: N-[4-[2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-1-oxopropyl]phenyl]-2-methylpropanamide IUPAC Name: N-[4-[2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanoyl]phenyl]-2-methylpropanamide Traditional Name: N-[4-[2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]propanoyl]phenyl]-2-methyl-propionamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C24H27N3O4S/c1-15(2)22(30)25-18-11-9-17(10-12-18)21(29)16(3)32-24-26-20-8-5-4-7-19(20)23(31)27(24)13-6-14-28/h4-5,7-12,15-16,28H,6,13-14H2,1-3H3,(H,25,30)