3-methoxy-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-(2-methylpropoxy)benzamide

Systemtic Name: 3-methoxy-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-(2-methylpropoxy)benzamide Openeye Name: 4-isobutoxy-3-methoxy-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-methoxy-N-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-(2-methylpropoxy)benzamide IUPAC Name: 3-methoxy-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-(2-methylpropoxy)benzamide Traditional Name: 4-isobutoxy-3-methoxy-N-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]benzamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)OCC(C)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)OCC(C)C)OC

InChI

InChI=1S/C22H25N3O3S2/c1-14(2)12-28-18-10-9-17(11-19(18)27-4)20(26)23-21-24-25-22(30-21)29-13-16-7-5-15(3)6-8-16/h5-11,14H,12-13H2,1-4H3,(H,23,24,26)