N-(furan-2-ylmethyl)-4-[2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]butanamide

Systemtic Name: N-(furan-2-ylmethyl)-4-[2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]butanamide Openeye Name: N-(2-furylmethyl)-4-[4-oxo-2-(p-tolylmethylsulfanyl)quinazolin-3-yl]butanamide CAS Name: N-(2-furanylmethyl)-4-[2-[(4-methylphenyl)methylthio]-4-oxo-3-quinazolinyl]butanamide IUPAC Name: N-(furan-2-ylmethyl)-4-[2-[(4-methylphenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]butanamide Traditional Name: N-(2-furfuryl)-4-[4-keto-2-[(4-methylbenzyl)thio]quinazolin-3-yl]butyramide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CCCC(=O)NCC4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CCCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C25H25N3O3S/c1-18-10-12-19(13-11-18)17-32-25-27-22-8-3-2-7-21(22)24(30)28(25)14-4-9-23(29)26-16-20-6-5-15-31-20/h2-3,5-8,10-13,15H,4,9,14,16-17H2,1H3,(H,26,29)