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

Systemtic Name: N-[4-[2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]phenyl]butanamide Openeye Name: N-[4-[2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]phenyl]butanamide CAS Name: N-[4-[2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]phenyl]butanamide IUPAC Name: N-[4-[2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylacetyl]phenyl]butanamide Traditional Name: N-[4-[2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]acetyl]phenyl]butyramide Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C23H23N3O3S/c1-2-5-21(28)24-16-10-8-15(9-11-16)20(27)14-30-23-25-19-7-4-3-6-18(19)22(29)26(23)17-12-13-17/h3-4,6-11,17H,2,5,12-14H2,1H3,(H,24,28)