(2R)-N-(4-bromophenyl)-2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-bromophenyl)-2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(4-bromophenyl)-2-[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-N-(4-bromophenyl)-2-[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-(4-bromophenyl)-2-[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(4-bromophenyl)-2-[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C22H18BrN3O3S MolecularWeight: 484.36562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Br)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)Br)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

InChI

InChI=1S/C22H18BrN3O3S/c1-14(20(27)24-16-10-8-15(23)9-11-16)30-22-25-19-7-3-2-6-18(19)21(28)26(22)13-17-5-4-12-29-17/h2-12,14H,13H2,1H3,(H,24,27)/t14-/m1/s1