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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-5-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-[(4-methoxyphenyl)methyl]-5-[(3-morpholinosulfonylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-[(4-methoxyphenyl)methyl]-5-[[3-(4-morpholinylsulfonyl)phenyl]methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-[(4-methoxyphenyl)methyl]-5-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-morpholinosulfonylbenzyl)thio]-1,3,4-thiadiazol-2-yl]-p-anisyl-amine Formula: C21H24N4O4S3 MolecularWeight: 492.63466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NN=C(S2)SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NN=C(S2)SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H24N4O4S3/c1-28-18-7-5-16(6-8-18)14-22-20-23-24-21(31-20)30-15-17-3-2-4-19(13-17)32(26,27)25-9-11-29-12-10-25/h2-8,13H,9-12,14-15H2,1H3,(H,22,23)