3-methyl-N-[4-[2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylethanoyl]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylethanoyl]phenyl]butanamide Openeye Name: N-[4-[2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]phenyl]-3-methyl-butanamide CAS Name: N-[4-[2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]phenyl]-3-methylbutanamide Traditional Name: N-[4-[2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]acetyl]phenyl]-3-methyl-butyramide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C24H27N3O4S/c1-16(2)14-22(30)25-18-10-8-17(9-11-18)21(29)15-32-24-26-20-7-4-3-6-19(20)23(31)27(24)12-5-13-28/h3-4,6-11,16,28H,5,12-15H2,1-2H3,(H,25,30)