2-oxidanylidene-N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]chromene-3-carboxamide

Systemtic Name: 2-oxidanylidene-N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]chromene-3-carboxamide Openeye Name: N-[5-(3-isopropylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-2-oxo-chromene-3-carboxamide CAS Name: 2-oxo-N-[5-[3-(propan-2-ylthio)phenyl]-1,3,4-oxadiazol-2-yl]-1-benzopyran-3-carboxamide IUPAC Name: 2-oxo-N-[5-(3-propan-2-ylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]chromene-3-carboxamide Traditional Name: N-[5-[3-(isopropylthio)phenyl]-1,3,4-oxadiazol-2-yl]-2-keto-chromene-3-carboxamide Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=CC(=C1)C2=NN=C(O2)NC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC(C)SC1=CC=CC(=C1)C2=NN=C(O2)NC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H17N3O4S/c1-12(2)29-15-8-5-7-14(10-15)19-23-24-21(28-19)22-18(25)16-11-13-6-3-4-9-17(13)27-20(16)26/h3-12H,1-2H3,(H,22,24,25)