N-(2,5-dimethylpyrazol-3-yl)-2-(4-oxidanylidene-3-prop-2-enyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethylpyrazol-3-yl)-2-(4-oxidanylidene-3-prop-2-enyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-[3-allyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(2,5-dimethylpyrazol-3-yl)acetamide CAS Name: N-(2,5-dimethyl-3-pyrazolyl)-2-[(4-oxo-3-prop-2-enyl-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(2,5-dimethylpyrazol-3-yl)-2-(4-oxo-3-prop-2-enyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[[3-allyl-4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-(2,5-dimethylpyrazol-3-yl)acetamide Formula: C20H19N5O2S3 MolecularWeight: 457.59216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CC=C)C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CC=C)C

InChI

InChI=1S/C20H19N5O2S3/c1-4-7-25-19(27)17-13(14-6-5-8-28-14)10-29-18(17)22-20(25)30-11-16(26)21-15-9-12(2)23-24(15)3/h4-6,8-10H,1,7,11H2,2-3H3,(H,21,26)