butyl 2-[[5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: butyl 2-[[5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: butyl 2-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]thio]acetic acid butyl ester IUPAC Name: butyl 2-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]thio]acetic acid butyl ester Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NN=C(S1)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)CSC1=NN=C(S1)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O3S2/c1-2-3-13-25-18(24)14-27-20-23-22-19(28-20)21-15-9-11-17(12-10-15)26-16-7-5-4-6-8-16/h4-12H,2-3,13-14H2,1H3,(H,21,22)