N-(1,3-benzothiazol-2-yl)-2-(5,6-dimethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-ethyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(5,6-dimethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-ethyl-ethanamide Openeye Name: 2-(3-allyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(1,3-benzothiazol-2-yl)-N-ethyl-acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(5,6-dimethyl-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-ethylacetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(5,6-dimethyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-ethylacetamide Traditional Name: 2-[(3-allyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(1,3-benzothiazol-2-yl)-N-ethyl-acetamide Formula: C22H22N4O2S3 MolecularWeight: 470.63068

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)CSC3=NC4=C(C(=C(S4)C)C)C(=O)N3CC=C

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)CSC3=NC4=C(C(=C(S4)C)C)C(=O)N3CC=C

InChI

InChI=1S/C22H22N4O2S3/c1-5-11-26-20(28)18-13(3)14(4)30-19(18)24-21(26)29-12-17(27)25(6-2)22-23-15-9-7-8-10-16(15)31-22/h5,7-10H,1,6,11-12H2,2-4H3