7-bromanyl-4-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 7-bromanyl-4-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-bromo-4-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-bromo-4-[[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-bromo-4-[[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C15H14BrN3O3S2 MolecularWeight: 428.32396

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NN=C(S1)SCC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

COCCNC1=NN=C(S1)SCC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

InChI=1S/C15H14BrN3O3S2/c1-21-5-4-17-14-18-19-15(24-14)23-8-9-6-13(20)22-12-7-10(16)2-3-11(9)12/h2-3,6-7H,4-5,8H2,1H3,(H,17,18)