2-(6-bromanyl-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamide

Systemtic Name: 2-(6-bromanyl-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamide Openeye Name: 2-(6-bromo-2-oxo-1,3-benzoxazol-3-yl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide CAS Name: 2-(6-bromo-2-oxo-1,3-benzoxazol-3-yl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide IUPAC Name: 2-(6-bromo-2-oxo-1,3-benzoxazol-3-yl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide Traditional Name: 2-(6-bromo-2-keto-1,3-benzoxazol-3-yl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C18H14BrN3O3S MolecularWeight: 432.29106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CN3C4=C(C=C(C=C4)Br)OC3=O)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CN3C4=C(C=C(C=C4)Br)OC3=O)C#N

InChI

InChI=1S/C18H14BrN3O3S/c19-10-5-6-13-14(7-10)25-18(24)22(13)9-16(23)21-17-12(8-20)11-3-1-2-4-15(11)26-17/h5-7H,1-4,9H2,(H,21,23)