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

Systemtic Name: N-[4-[2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[2-[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]phenyl]-3-methyl-butanamide CAS Name: N-[4-[2-[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[2-[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]phenyl]-3-methylbutanamide Traditional Name: N-[4-[2-[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]acetyl]phenyl]-3-methyl-butyramide Formula: C26H25N3O4S MolecularWeight: 475.5594

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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)N2CC4=CC=CO4

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

InChI

InChI=1S/C26H25N3O4S/c1-17(2)14-24(31)27-19-11-9-18(10-12-19)23(30)16-34-26-28-22-8-4-3-7-21(22)25(32)29(26)15-20-6-5-13-33-20/h3-13,17H,14-16H2,1-2H3,(H,27,31)