2-[4-oxidanylidene-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[4-oxo-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[[4-oxo-3-(4-phenoxyphenyl)-2-quinazolinyl]thio]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[4-oxo-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[[4-keto-3-(4-phenoxyphenyl)quinazolin-2-yl]thio]-N-(2-thenyl)acetamide Formula: C27H21N3O3S2 MolecularWeight: 499.60394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4N=C3SCC(=O)NCC5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4N=C3SCC(=O)NCC5=CC=CS5

InChI

InChI=1S/C27H21N3O3S2/c31-25(28-17-22-9-6-16-34-22)18-35-27-29-24-11-5-4-10-23(24)26(32)30(27)19-12-14-21(15-13-19)33-20-7-2-1-3-8-20/h1-16H,17-18H2,(H,28,31)