N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-propoxy-benzamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-propoxy-benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-4-propoxy-benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-4-propoxybenzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-propoxybenzamide Traditional Name: N-(4-methyl-5-piperonyl-thiazol-2-yl)-4-propoxy-benzamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC2=NC(=C(S2)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC2=NC(=C(S2)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C22H22N2O4S/c1-3-10-26-17-7-5-16(6-8-17)21(25)24-22-23-14(2)20(29-22)12-15-4-9-18-19(11-15)28-13-27-18/h4-9,11H,3,10,12-13H2,1-2H3,(H,23,24,25)