4-[[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 4-[[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]methyl]-N-phenyl-benzamide Formula: C27H21N3O3S MolecularWeight: 467.53894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CO5

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CO5

InChI

InChI=1S/C27H21N3O3S/c31-25(28-21-7-2-1-3-8-21)20-14-12-19(13-15-20)18-34-27-29-24-11-5-4-10-23(24)26(32)30(27)17-22-9-6-16-33-22/h1-16H,17-18H2,(H,28,31)