N-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]-4-phenylsulfanyl-butanamide

Systemtic Name: N-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]-4-phenylsulfanyl-butanamide Openeye Name: N-[4-(2-oxochromen-3-yl)thiazol-2-yl]-4-phenylsulfanyl-butanamide CAS Name: N-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-4-(phenylthio)butanamide IUPAC Name: N-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]-4-phenylsulfanylbutanamide Traditional Name: N-[4-(2-ketochromen-3-yl)thiazol-2-yl]-4-(phenylthio)butyramide Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCC(=O)NC2=NC(=CS2)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1=CC=C(C=C1)SCCCC(=O)NC2=NC(=CS2)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H18N2O3S2/c25-20(11-6-12-28-16-8-2-1-3-9-16)24-22-23-18(14-29-22)17-13-15-7-4-5-10-19(15)27-21(17)26/h1-5,7-10,13-14H,6,11-12H2,(H,23,24,25)