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

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[(4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide Formula: C18H13FN4O2S3 MolecularWeight: 432.514823

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCC(=O)NC3=NC4=C(S3)C=C(C=C4)F)SC=C2

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCC(=O)NC3=NC4=C(S3)C=C(C=C4)F)SC=C2

InChI

InChI=1S/C18H13FN4O2S3/c1-2-6-23-16(25)11-5-7-26-15(11)22-18(23)27-9-14(24)21-17-20-12-4-3-10(19)8-13(12)28-17/h2-5,7-8H,1,6,9H2,(H,20,21,24)