N,N-diethyl-3-[2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoylamino]benzamide

Systemtic Name: N,N-diethyl-3-[2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoylamino]benzamide Openeye Name: N,N-diethyl-3-[2-(3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoylamino]benzamide CAS Name: N,N-diethyl-3-[[2-[(3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-1-oxopropyl]amino]benzamide IUPAC Name: N,N-diethyl-3-[2-(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoylamino]benzamide Traditional Name: N,N-diethyl-3-[2-[(4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]propanoylamino]benzamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C(C)SC2=NC3=C(C=CS3)C(=O)N2C

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C(C)SC2=NC3=C(C=CS3)C(=O)N2C

InChI

InChI=1S/C21H24N4O3S2/c1-5-25(6-2)19(27)14-8-7-9-15(12-14)22-17(26)13(3)30-21-23-18-16(10-11-29-18)20(28)24(21)4/h7-13H,5-6H2,1-4H3,(H,22,26)