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

Systemtic Name: N-(3-methylphenyl)-5-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-morpholinosulfonylphenyl)methylsulfanyl]-N-(m-tolyl)-1,3,4-thiadiazol-2-amine CAS Name: N-(3-methylphenyl)-5-[[3-(4-morpholinylsulfonyl)phenyl]methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-methylphenyl)-5-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-morpholinosulfonylbenzyl)thio]-1,3,4-thiadiazol-2-yl]-(m-tolyl)amine Formula: C20H22N4O3S3 MolecularWeight: 462.60868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H22N4O3S3/c1-15-4-2-6-17(12-15)21-19-22-23-20(29-19)28-14-16-5-3-7-18(13-16)30(25,26)24-8-10-27-11-9-24/h2-7,12-13H,8-11,14H2,1H3,(H,21,22)