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

Systemtic Name: 7-bromanyl-4-[[5-[(4-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-bromo-4-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-bromo-4-[[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-bromo-4-[[[5-(p-anisidino)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C19H14BrN3O3S2 MolecularWeight: 476.36676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NN=C(S2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NN=C(S2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C19H14BrN3O3S2/c1-25-14-5-3-13(4-6-14)21-18-22-23-19(28-18)27-10-11-8-17(24)26-16-9-12(20)2-7-15(11)16/h2-9H,10H2,1H3,(H,21,22)