N-(4-methoxyphenyl)-5-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(4-methoxyphenyl)-5-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-(4-methoxyphenyl)-5-[(3-morpholinosulfonylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(4-methoxyphenyl)-5-[[3-(4-morpholinylsulfonyl)phenyl]methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(4-methoxyphenyl)-5-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: (4-methoxyphenyl)-[5-[(3-morpholinosulfonylbenzyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C20H22N4O4S3 MolecularWeight: 478.60808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NN=C(S2)SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NN=C(S2)SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H22N4O4S3/c1-27-17-7-5-16(6-8-17)21-19-22-23-20(30-19)29-14-15-3-2-4-18(13-15)31(25,26)24-9-11-28-12-10-24/h2-8,13H,9-12,14H2,1H3,(H,21,22)