N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-butyl-4-methyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-butyl-4-methyl-1,3-thiazole-5-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-2-butyl-4-methyl-thiazole-5-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-2-butyl-4-methyl-5-thiazolecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-butyl-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: 2-butyl-4-methyl-N-(4-methyl-5-piperonyl-thiazol-2-yl)thiazole-5-carboxamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(S1)C(=O)NC2=NC(=C(S2)CC3=CC4=C(C=C3)OCO4)C)C

Isomeric SMILES

CCCCC1=NC(=C(S1)C(=O)NC2=NC(=C(S2)CC3=CC4=C(C=C3)OCO4)C)C

InChI

InChI=1S/C21H23N3O3S2/c1-4-5-6-18-22-13(3)19(29-18)20(25)24-21-23-12(2)17(28-21)10-14-7-8-15-16(9-14)27-11-26-15/h7-9H,4-6,10-11H2,1-3H3,(H,23,24,25)