4,5-dimethyl-2-[2-(3-methylphenoxy)ethanoylcarbamothioylamino]thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-2-[2-(3-methylphenoxy)ethanoylcarbamothioylamino]thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-2-[[2-(3-methylphenoxy)acetyl]carbamothioylamino]thiophene-3-carboxamide CAS Name: 4,5-dimethyl-2-[[[[2-(3-methylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-2-[[2-(3-methylphenoxy)acetyl]carbamothioylamino]thiophene-3-carboxamide Traditional Name: 4,5-dimethyl-2-[[2-(3-methylphenoxy)acetyl]thiocarbamoylamino]thiophene-3-carboxamide Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)N

InChI

InChI=1S/C17H19N3O3S2/c1-9-5-4-6-12(7-9)23-8-13(21)19-17(24)20-16-14(15(18)22)10(2)11(3)25-16/h4-7H,8H2,1-3H3,(H2,18,22)(H2,19,20,21,24)