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

Systemtic Name: N-[5-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-yl]-4-(2-methylpropoxy)benzamide Openeye Name: N-[5-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-yl]-4-isobutoxy-benzamide CAS Name: N-[5-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-yl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-[5-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-yl]-4-(2-methylpropoxy)benzamide Traditional Name: N-[5-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-yl]-4-isobutoxy-benzamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O2S/c1-13(2)12-26-18-9-7-16(8-10-18)19(25)22-21-24-23-20(27-21)17-6-5-14(3)15(4)11-17/h5-11,13H,12H2,1-4H3,(H,22,24,25)