2-[[5-[(4-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-morpholin-4-ylphenyl)propanamide

Systemtic Name: 2-[[5-[(4-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-morpholin-4-ylphenyl)propanamide Openeye Name: 2-[[5-(4-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-morpholinophenyl)propanamide CAS Name: 2-[[5-(4-methylanilino)-1,3,4-thiadiazol-2-yl]thio]-N-[4-(4-morpholinyl)phenyl]propanamide IUPAC Name: 2-[[5-(4-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: N-(4-morpholinophenyl)-2-[[5-(p-toluidino)-1,3,4-thiadiazol-2-yl]thio]propionamide Formula: C22H25N5O2S2 MolecularWeight: 455.5962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NN=C(S2)SC(C)C(=O)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN=C(S2)SC(C)C(=O)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C22H25N5O2S2/c1-15-3-5-18(6-4-15)24-21-25-26-22(31-21)30-16(2)20(28)23-17-7-9-19(10-8-17)27-11-13-29-14-12-27/h3-10,16H,11-14H2,1-2H3,(H,23,28)(H,24,25)