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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-methylthiazol-4-yl)methylsulfanyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-methyl-4-thiazolyl)methylthio]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide Traditional Name: 4-[(2-methylthiazol-4-yl)methylthio]-N-piperonyl-benzamide Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18N2O3S2/c1-13-22-16(10-26-13)11-27-17-5-3-15(4-6-17)20(23)21-9-14-2-7-18-19(8-14)25-12-24-18/h2-8,10H,9,11-12H2,1H3,(H,21,23)