N-tert-butyl-2-[5-(4-chlorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[5-(4-chlorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide Openeye Name: N-tert-butyl-2-[5-(4-chlorophenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: N-tert-butyl-2-[5-(4-chlorophenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-tert-butyl-2-[5-(4-chlorophenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide Traditional Name: N-tert-butyl-2-[5-(4-chlorophenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]acetamide Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)NC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O2S/c1-18(2,3)21-14(23)8-22-10-20-16-15(17(22)24)13(9-25-16)11-4-6-12(19)7-5-11/h4-7,9-10H,8H2,1-3H3,(H,21,23)