2-[(3-butyl-4-oxidanylidene-[1]benzofuro[3,2-d]pyrimidin-2-yl)sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[(3-butyl-4-oxidanylidene-[1]benzofuro[3,2-d]pyrimidin-2-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-(3-butyl-4-oxo-benzofuro[3,2-d]pyrimidin-2-yl)sulfanyl-N-phenyl-acetamide CAS Name: 2-[(3-butyl-4-oxo-2-benzofuro[3,2-d]pyrimidinyl)thio]-N-phenylacetamide IUPAC Name: 2-[(3-butyl-4-oxo-[1]benzofuro[3,2-d]pyrimidin-2-yl)sulfanyl]-N-phenylacetamide Traditional Name: 2-[(3-butyl-4-keto-benzofuro[3,2-d]pyrimidin-2-yl)thio]-N-phenyl-acetamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C3=CC=CC=C3O2)N=C1SCC(=O)NC4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=O)C2=C(C3=CC=CC=C3O2)N=C1SCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3S/c1-2-3-13-25-21(27)20-19(16-11-7-8-12-17(16)28-20)24-22(25)29-14-18(26)23-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3,(H,23,26)