N-[4-[2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]phenyl]propanamide

Systemtic Name: N-[4-[2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]phenyl]propanamide CAS Name: N-[4-[2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]phenyl]propanamide IUPAC Name: N-[4-[2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]phenyl]propanamide Traditional Name: N-[4-[2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]acetyl]phenyl]propionamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC(C)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC(C)C

InChI

InChI=1S/C24H27N3O3S/c1-4-22(29)25-18-11-9-17(10-12-18)21(28)15-31-24-26-20-8-6-5-7-19(20)23(30)27(24)14-13-16(2)3/h5-12,16H,4,13-15H2,1-3H3,(H,25,29)