N-[4-[chloranyl-bis(fluoranyl)methoxy]phenyl]-2-[(4-oxidanylidene-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[4-[chloranyl-bis(fluoranyl)methoxy]phenyl]-2-[(4-oxidanylidene-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-[4-[chloro(difluoro)methoxy]phenyl]-2-[(4-oxo-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-[4-[chloro(difluoro)methoxy]phenyl]-2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]acetamide IUPAC Name: N-[4-[chloro(difluoro)methoxy]phenyl]-2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-[4-[chloro(difluoro)methoxy]phenyl]-2-[(4-keto-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C19H16ClF2N3O3S2 MolecularWeight: 471.928446

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)SCC(=O)NC4=CC=C(C=C4)OC(F)(F)Cl

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)SCC(=O)NC4=CC=C(C=C4)OC(F)(F)Cl

InChI

InChI=1S/C19H16ClF2N3O3S2/c20-19(21,22)28-11-7-5-10(6-8-11)23-14(26)9-29-18-24-16(27)15-12-3-1-2-4-13(12)30-17(15)25-18/h5-8H,1-4,9H2,(H,23,26)(H,24,25,27)