N-butyl-3-methoxy-4-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]oxy]benzamide

Systemtic Name: N-butyl-3-methoxy-4-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]oxy]benzamide Openeye Name: 4-[(3-benzyl-1,2,4-thiadiazol-5-yl)oxy]-N-butyl-3-methoxy-benzamide CAS Name: N-butyl-3-methoxy-4-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]oxy]benzamide IUPAC Name: 4-[(3-benzyl-1,2,4-thiadiazol-5-yl)oxy]-N-butyl-3-methoxybenzamide Traditional Name: 4-[(3-benzyl-1,2,4-thiadiazol-5-yl)oxy]-N-butyl-3-methoxy-benzamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=C(C=C1)OC2=NC(=NS2)CC3=CC=CC=C3)OC

Isomeric SMILES

CCCCNC(=O)C1=CC(=C(C=C1)OC2=NC(=NS2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C21H23N3O3S/c1-3-4-12-22-20(25)16-10-11-17(18(14-16)26-2)27-21-23-19(24-28-21)13-15-8-6-5-7-9-15/h5-11,14H,3-4,12-13H2,1-2H3,(H,22,25)