N-(3-chloranyl-2,6-diethyl-phenyl)-2-(4-oxidanylidenethieno[3,2-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-2-(4-oxidanylidenethieno[3,2-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-2-(4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-2-(4-oxo-3-thieno[3,2-d]pyrimidinyl)acetamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-2-(4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-2-(4-ketothieno[3,2-d]pyrimidin-3-yl)acetamide Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CN2C=NC3=C(C2=O)SC=C3

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CN2C=NC3=C(C2=O)SC=C3

InChI

InChI=1S/C18H18ClN3O2S/c1-3-11-5-6-13(19)12(4-2)16(11)21-15(23)9-22-10-20-14-7-8-25-17(14)18(22)24/h5-8,10H,3-4,9H2,1-2H3,(H,21,23)