N-cyclohexyl-2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: N-cyclohexyl-2-[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-phenyl-acetamide CAS Name: N-cyclohexyl-2-[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]-N-phenylacetamide IUPAC Name: N-cyclohexyl-2-[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: N-cyclohexyl-2-[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]-N-phenyl-acetamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CO5

Isomeric SMILES

C1CCC(CC1)N(C2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CO5

InChI

InChI=1S/C27H27N3O3S/c31-25(30(20-10-3-1-4-11-20)21-12-5-2-6-13-21)19-34-27-28-24-16-8-7-15-23(24)26(32)29(27)18-22-14-9-17-33-22/h1,3-4,7-11,14-17,21H,2,5-6,12-13,18-19H2