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

Systemtic Name: 7-methoxy-4-[[5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-methoxy-4-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-methoxy-4-[[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-methoxy-4-[[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C25H19N3O4S2 MolecularWeight: 489.56606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(S3)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(S3)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H19N3O4S2/c1-30-20-11-12-21-16(13-23(29)32-22(21)14-20)15-33-25-28-27-24(34-25)26-17-7-9-19(10-8-17)31-18-5-3-2-4-6-18/h2-14H,15H2,1H3,(H,26,27)