N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-5-isopropyl-isoxazole-3-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-propan-2-yl-3-isoxazolecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-5-isopropyl-isoxazole-3-carboxamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NO1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CC(C)C1=CC(=NO1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C16H17N3O2S/c1-9(2)13-7-12(19-21-13)15(20)18-16-11(8-17)10-5-3-4-6-14(10)22-16/h7,9H,3-6H2,1-2H3,(H,18,20)