2-[[3-bromanyl-4-(2-methoxyethoxy)phenyl]carbonylcarbamothioylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: 2-[[3-bromanyl-4-(2-methoxyethoxy)phenyl]carbonylcarbamothioylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-[[3-bromo-4-(2-methoxyethoxy)benzoyl]carbamothioylamino]-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[[[[3-bromo-4-(2-methoxyethoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methyl-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-[[3-bromo-4-(2-methoxyethoxy)benzoyl]carbamothioylamino]-4-methylthiophene-3-carboxamide Traditional Name: 5-benzyl-2-[[3-bromo-4-(2-methoxyethoxy)benzoyl]thiocarbamoylamino]-4-methyl-thiophene-3-carboxamide Formula: C24H24BrN3O4S2 MolecularWeight: 562.49906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br)CC3=CC=CC=C3

InChI

InChI=1S/C24H24BrN3O4S2/c1-14-19(12-15-6-4-3-5-7-15)34-23(20(14)21(26)29)28-24(33)27-22(30)16-8-9-18(17(25)13-16)32-11-10-31-2/h3-9,13H,10-12H2,1-2H3,(H2,26,29)(H2,27,28,30,33)