N-[3-(4-ethoxy-3-methoxy-phenyl)-1,2,4-thiadiazol-5-yl]-3-propoxy-benzamide

Systemtic Name: N-[3-(4-ethoxy-3-methoxy-phenyl)-1,2,4-thiadiazol-5-yl]-3-propoxy-benzamide Openeye Name: N-[3-(4-ethoxy-3-methoxy-phenyl)-1,2,4-thiadiazol-5-yl]-3-propoxy-benzamide CAS Name: N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-propoxybenzamide IUPAC Name: N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-propoxybenzamide Traditional Name: N-[3-(4-ethoxy-3-methoxy-phenyl)-1,2,4-thiadiazol-5-yl]-3-propoxy-benzamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC2=NC(=NS2)C3=CC(=C(C=C3)OCC)OC

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC2=NC(=NS2)C3=CC(=C(C=C3)OCC)OC

InChI

InChI=1S/C21H23N3O4S/c1-4-11-28-16-8-6-7-15(12-16)20(25)23-21-22-19(24-29-21)14-9-10-17(27-5-2)18(13-14)26-3/h6-10,12-13H,4-5,11H2,1-3H3,(H,22,23,24,25)