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

Systemtic Name: 2-[[3-(2-ethoxyethoxy)phenyl]carbonylcarbamothioylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[[[[3-(2-ethoxyethoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methyl-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-4-methylthiophene-3-carboxamide Traditional Name: 5-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]thiocarbamoylamino]-4-methyl-thiophene-3-carboxamide Formula: C25H27N3O4S2 MolecularWeight: 497.62958

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C(=C(S2)CC3=CC=CC=C3)C)C(=O)N

Isomeric SMILES

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C(=C(S2)CC3=CC=CC=C3)C)C(=O)N

InChI

InChI=1S/C25H27N3O4S2/c1-3-31-12-13-32-19-11-7-10-18(15-19)23(30)27-25(33)28-24-21(22(26)29)16(2)20(34-24)14-17-8-5-4-6-9-17/h4-11,15H,3,12-14H2,1-2H3,(H2,26,29)(H2,27,28,30,33)