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

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-5-bromanyl-thiophene-2-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-5-bromo-thiophene-2-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-5-bromo-2-thiophenecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-5-bromothiophene-2-carboxamide Traditional Name: 5-bromo-N-(4-methyl-5-piperonyl-thiazol-2-yl)thiophene-2-carboxamide Formula: C17H13BrN2O3S2 MolecularWeight: 437.33072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC=C(S2)Br)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC=C(S2)Br)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H13BrN2O3S2/c1-9-14(7-10-2-3-11-12(6-10)23-8-22-11)25-17(19-9)20-16(21)13-4-5-15(18)24-13/h2-6H,7-8H2,1H3,(H,19,20,21)