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

Systemtic Name: N-[4-[2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]phenyl]propanamide CAS Name: N-[4-[2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]phenyl]propanamide IUPAC Name: N-[4-[2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]phenyl]propanamide Traditional Name: N-[4-[2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]acetyl]phenyl]propionamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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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)N2CC(C)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC(C)C

InChI

InChI=1S/C23H25N3O3S/c1-4-21(28)24-17-11-9-16(10-12-17)20(27)14-30-23-25-19-8-6-5-7-18(19)22(29)26(23)13-15(2)3/h5-12,15H,4,13-14H2,1-3H3,(H,24,28)