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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O3S/c1-3-4-5-16(20)19-17-18-11(2)15(23-17)9-12-6-7-13-14(8-12)22-10-21-13/h6-8H,3-5,9-10H2,1-2H3,(H,18,19,20)