3-[2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]ethanoyl]chromen-2-one

Systemtic Name: 3-[2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]ethanoyl]chromen-2-one Openeye Name: 3-[2-[4-(p-tolyl)thiazol-2-yl]sulfanylacetyl]chromen-2-one CAS Name: 3-[2-[[4-(4-methylphenyl)-2-thiazolyl]thio]-1-oxoethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]acetyl]chromen-2-one Traditional Name: 3-[2-[[4-(p-tolyl)thiazol-2-yl]thio]acetyl]coumarin Formula: C21H15NO3S2 MolecularWeight: 393.4787

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)SCC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)SCC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H15NO3S2/c1-13-6-8-14(9-7-13)17-11-26-21(22-17)27-12-18(23)16-10-15-4-2-3-5-19(15)25-20(16)24/h2-11H,12H2,1H3