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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)OCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)OCC(C)C

InChI

InChI=1S/C21H23N3O2S/c1-14(2)13-26-18-9-7-17(8-10-18)20(25)22-21-24-23-19(27-21)12-16-6-4-5-15(3)11-16/h4-11,14H,12-13H2,1-3H3,(H,22,24,25)