6-chloranyl-7-ethyl-4-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-ethyl-4-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]chromen-2-one Openeye Name: 6-chloro-7-ethyl-4-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 6-chloro-7-ethyl-4-[[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-ethyl-4-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]chromen-2-one Traditional Name: 6-chloro-7-ethyl-4-[[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]thio]methyl]coumarin Formula: C18H13ClN2O3S2 MolecularWeight: 404.89042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(O3)C4=CC=CS4)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(O3)C4=CC=CS4)Cl

InChI

InChI=1S/C18H13ClN2O3S2/c1-2-10-6-14-12(8-13(10)19)11(7-16(22)23-14)9-26-18-21-20-17(24-18)15-4-3-5-25-15/h3-8H,2,9H2,1H3