N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: 4-morpholinosulfonyl-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: 4-morpholinosulfonyl-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C20H20N4O4S2 MolecularWeight: 444.5272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H20N4O4S2/c1-14-3-2-4-16(13-14)19-22-23-20(29-19)21-18(25)15-5-7-17(8-6-15)30(26,27)24-9-11-28-12-10-24/h2-8,13H,9-12H2,1H3,(H,21,23,25)