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

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-methyl-butanamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-2-methyl-butanamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-2-methylbutanamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-methylbutanamide Traditional Name: 2-methyl-N-(4-methyl-5-piperonyl-thiazol-2-yl)butyramide Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NC1=NC(=C(S1)CC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCC(C)C(=O)NC1=NC(=C(S1)CC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C17H20N2O3S/c1-4-10(2)16(20)19-17-18-11(3)15(23-17)8-12-5-6-13-14(7-12)22-9-21-13/h5-7,10H,4,8-9H2,1-3H3,(H,18,19,20)