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

Systemtic Name: 3-methyl-N-[4-[2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]phenyl]butanamide Openeye Name: 3-methyl-N-[4-[2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]phenyl]butanamide CAS Name: 3-methyl-N-[4-[2-[(3-methyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-[2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetyl]phenyl]butanamide Traditional Name: N-[4-[2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetyl]phenyl]-3-methyl-butyramide Formula: C22H23N3O3S MolecularWeight: 409.50132

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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)N2C

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C22H23N3O3S/c1-14(2)12-20(27)23-16-10-8-15(9-11-16)19(26)13-29-22-24-18-7-5-4-6-17(18)21(28)25(22)3/h4-11,14H,12-13H2,1-3H3,(H,23,27)