N-(4-bromanyl-2,6-dimethyl-phenyl)-2-[3-(furan-2-ylmethyl)-6,7-dimethoxy-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide

Systemtic Name: N-(4-bromanyl-2,6-dimethyl-phenyl)-2-[3-(furan-2-ylmethyl)-6,7-dimethoxy-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N-(4-bromo-2,6-dimethyl-phenyl)-2-[3-(2-furylmethyl)-6,7-dimethoxy-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: N-(4-bromo-2,6-dimethylphenyl)-2-[[3-(2-furanylmethyl)-6,7-dimethoxy-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N-(4-bromo-2,6-dimethylphenyl)-2-[3-(furan-2-ylmethyl)-6,7-dimethoxy-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N-(4-bromo-2,6-dimethyl-phenyl)-2-[[3-(2-furfuryl)-4-keto-6,7-dimethoxy-quinazolin-2-yl]thio]butyramide Formula: C27H28BrN3O5S MolecularWeight: 586.49732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1C)Br)C)SC2=NC3=CC(=C(C=C3C(=O)N2CC4=CC=CO4)OC)OC

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1C)Br)C)SC2=NC3=CC(=C(C=C3C(=O)N2CC4=CC=CO4)OC)OC

InChI

InChI=1S/C27H28BrN3O5S/c1-6-23(25(32)30-24-15(2)10-17(28)11-16(24)3)37-27-29-20-13-22(35-5)21(34-4)12-19(20)26(33)31(27)14-18-8-7-9-36-18/h7-13,23H,6,14H2,1-5H3,(H,30,32)