ethyl 5-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 5-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoyl]amino]benzothiophene-2-carboxylate CAS Name: 5-[[[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoyl]amino]benzothiophene-2-carboxylic acid ethyl ester Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)C4=NC(=NO4)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)C4=NC(=NO4)C

InChI

InChI=1S/C21H17N3O4S/c1-3-27-21(26)18-11-15-10-16(8-9-17(15)29-18)23-19(25)13-4-6-14(7-5-13)20-22-12(2)24-28-20/h4-11H,3H2,1-2H3,(H,23,25)