4,5-dimethyl-2-[2-(6-methylpyrimidin-4-yl)sulfanylbutanoylamino]thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-2-[2-(6-methylpyrimidin-4-yl)sulfanylbutanoylamino]thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-2-[2-(6-methylpyrimidin-4-yl)sulfanylbutanoylamino]thiophene-3-carboxamide CAS Name: 4,5-dimethyl-2-[[2-[(6-methyl-4-pyrimidinyl)thio]-1-oxobutyl]amino]-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-2-[2-(6-methylpyrimidin-4-yl)sulfanylbutanoylamino]thiophene-3-carboxamide Traditional Name: 4,5-dimethyl-2-[2-[(6-methylpyrimidin-4-yl)thio]butanoylamino]thiophene-3-carboxamide Formula: C16H20N4O2S2 MolecularWeight: 364.4856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(S1)C)C)C(=O)N)SC2=NC=NC(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(S1)C)C)C(=O)N)SC2=NC=NC(=C2)C

InChI

InChI=1S/C16H20N4O2S2/c1-5-11(24-12-6-8(2)18-7-19-12)15(22)20-16-13(14(17)21)9(3)10(4)23-16/h6-7,11H,5H2,1-4H3,(H2,17,21)(H,20,22)